Mrv0541 11081312482D          

 19 20  0  0  0  0            999 V2000
    2.6258   -2.8226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6258   -1.9852    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9065   -0.7479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8981   -1.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3306   -3.2308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6343   -0.3248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9272   -3.2288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3306   -4.0683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6198    0.5042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9187   -4.0517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6465   -4.4660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0584   -2.8077    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3536   -0.7246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1848   -2.8229    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1788   -0.3336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1849   -1.9855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0523   -4.5056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4801   -0.7398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4655   -1.5857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  5  1  1  0  0  0  0
  7  1  2  0  0  0  0
  4  2  1  0  0  0  0
  4  3  1  0  0  0  0
  6  3  1  0  0  0  0
 15  3  2  0  0  0  0
 16  4  2  0  0  0  0
  8  5  2  0  0  0  0
 12  5  1  0  0  0  0
  9  6  2  0  0  0  0
 13  6  1  0  0  0  0
 10  7  1  0  0  0  0
 14  7  1  0  0  0  0
 17  8  1  0  0  0  0
 11  8  1  0  0  0  0
 11 10  2  0  0  0  0
 18 15  1  0  0  0  0
 19 16  1  0  0  0  0
 19 18  2  0  0  0  0
M  END
> <ID>
CHEBI:6710

> <NAME>
meclofenamic acid

> <DEFINITION>
An aminobenzoic acid that is anthranilic acid in which one of the hydrogens attached to the nitrogen is replaced by a 2,6-dichloro-3-methylphenyl group. A non-steroidal anti-inflammatory drug, it is used as the sodium salt for the treatment of dysmenorrhoea (painful periods), osteoarthritis and rheumatoid arthritis.

> <STAR>
3

> <SYNONYM>
N-(3-methyl-2,6-dichlorophenyl)anthranilic acid; N-(2,6-dichloro-m-tolyl)anthranilic acid; N-(2,6-dichloro-3-methylphenyl)anthranilic acid; INF 4668; CI-583

> <IUPAC_NAME>
2-[(2,6-dichloro-3-methylphenyl)amino]benzoic acid

> <INN>
meclofenamic acid; acidum meclofenamicum; acido meclofenamico; acide meclofenamique

> <FORMULA>
C14H11Cl2NO2

> <MASS>
296.14900

> <MONOISOTOPIC_MASS>
295.01668

> <CHARGE>
0

> <SMILES>
Cc1ccc(Cl)c(Nc2ccccc2C(O)=O)c1Cl

> <INCHI>
InChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)

> <INCHIKEY>
SBDNJUWAMKYJOX-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
644-62-2

> <REAXYS_REGISTRY_NUMBER>
2221428

> <CHEMIDPLUS>
644-62-2

> <DRUGBANK_ACCESSION>
DB00939

> <KEGG_COMPOUND_ACCESSION>
C07117

> <KEGG_DRUG_ACCESSION>
D02341

> <LINCS_ACCESSION>
LSM-3108

> <NIST_CHEMISTRY_WEBBOOK>
644-62-2

> <PDBECHEM_ACCESSION>
JMS

> <WIKIPEDIA_ACCESSION>
Meclofenamic_acid

> <PUBMED_CITATION>
15598972; 16986603; 17348907; 1810521; 19279153; 21660425; 23534549; 23567745; 23584353; 322627; 7349327

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