CHEBI:83595 - (S)-eberconazole nitrate

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ChEBI Name (S)-eberconazole nitrate
ChEBI ID CHEBI:83595
ChEBI ASCII Name (S)-eberconazole nitrate
Definition An organic nitrate salt obtained by reaction of equimolar amounts of (S)-eberconazole and nitric acid.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H15Cl2N3O3
Net Charge 0
Average Mass 392.23600
Monoisotopic Mass 391.04905
InChI InChI=1S/C18H14Cl2N2.HNO3/c19-14-9-13-6-5-12-3-1-2-4-15(12)18(17(13)16(20)10-14)22-8-7-21-11-22;2-1(3)4/h1-4,7-11,18H,5-6H2;(H,2,3,4)/t18-;/m0./s1
InChIKey DPHMSVRBAXJSPF-FERBBOLQSA-N
SMILES O[N+]([O-])=O.Clc1cc(Cl)c2[C@H](c3ccccc3CCc2c1)n1ccnc1
ChEBI Ontology
Outgoing (S)-eberconazole nitrate (CHEBI:83595) has part (S)-eberconazole(1+) (CHEBI:83596)
(S)-eberconazole nitrate (CHEBI:83595) is a organic nitrate salt (CHEBI:51085)
(S)-eberconazole nitrate (CHEBI:83595) is enantiomer of (R)-eberconazole nitrate (CHEBI:83592)
Incoming eberconazole nitrate (CHEBI:83589) has part (S)-eberconazole nitrate (CHEBI:83595)
(R)-eberconazole nitrate (CHEBI:83592) is enantiomer of (S)-eberconazole nitrate (CHEBI:83595)
IUPAC Name
1-[(5S)-2,4-dichloro-10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-yl]-1H-imidazole nitrate
Synonym Source
(S)-eberconazole mononitrate ChEBI
Last Modified
09 July 2015