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CHEBI:59035 - 5-(dimethylamino)-N-(4-nitrosobenzyl)naphthalene-1-sulfonamide

ChEBI IDCHEBI:59035
ChEBI Name5-(dimethylamino)-N-(4-nitrosobenzyl)naphthalene-1-sulfonamide
Stars
ASCII Name5-(dimethylamino)-N-(4-nitrosobenzyl)naphthalene-1-sulfonamide
DefinitionA sulfonamide obtained by formal condensation of the sulfo group of 5-(dimethylamino)-naphthalene-1-sulfonic acid with the amino group of 4-nitrosobenzylamine.
Last Modified12 March 2019
Submitterzjosephs
DownloadsMolfile
FormulaC19H19N3O3S
Net Charge0
Average Mass369.446
Monoisotopic Mass369.11471
SMILESCN(C)c1cccc2c(S(=O)(=O)NCc3ccc(N=O)cc3)cccc12
InChIInChI=1S/C19H19N3O3S/c1-22(2)18-7-3-6-17-16(18)5-4-8-19(17)26(24,25)20-13-14-9-11-15(21-23)12-10-14/h3-12,20H,13H2,1-2H3
InChIKeyXKTQDSMBOPQHOR-UHFFFAOYSA-N
Roles Classification
Biological Roles:
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
hapten  Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
ChEBI Ontology
Outgoing Relation(s)
5-(dimethylamino)-N-(4-nitrosobenzyl)naphthalene-1-sulfonamide (CHEBI:59035) has role allergen (CHEBI:50904)
5-(dimethylamino)-N-(4-nitrosobenzyl)naphthalene-1-sulfonamide (CHEBI:59035) has role hapten (CHEBI:59174)
5-(dimethylamino)-N-(4-nitrosobenzyl)naphthalene-1-sulfonamide (CHEBI:59035) is a nitroso compound (CHEBI:35800)
5-(dimethylamino)-N-(4-nitrosobenzyl)naphthalene-1-sulfonamide (CHEBI:59035) is a sulfonamide (CHEBI:35358)
IUPAC Name 
5-(dimethylamino)-N-[(4-nitrosophenyl)methyl]naphthalene-1-sulfonamide
Synonyms  Source
DNS-4NSBAChEBI
DNSBA-NOChEBI
5-(dimethylamino)-N-(4-nitrosobenzyl)naphthalene-1-sulfonamideIUPAC
Citations