2-[[2-[2-[(3-methylphenyl)methylidene]hydrazinyl]-5-nitro-phenyl]sulfonylamino]benzoic acid

Systemtic Name: 2-[[2-[2-[(3-methylphenyl)methylidene]hydrazinyl]-5-nitro-phenyl]sulfonylamino]benzoic acid Openeye Name: 2-[[2-[2-(m-tolylmethylene)hydrazino]-5-nitro-phenyl]sulfonylamino]benzoic acid CAS Name: 2-[[2-[2-[(3-methylphenyl)methylidene]hydrazinyl]-5-nitrophenyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[2-[2-[(3-methylphenyl)methylidene]hydrazinyl]-5-nitrophenyl]sulfonylamino]benzoic acid Traditional Name: 2-[[2-[N'-(3-methylbenzylidene)hydrazino]-5-nitro-phenyl]sulfonylamino]benzoic acid Formula: C21H18N4O6S MolecularWeight: 454.45582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H18N4O6S/c1-14-5-4-6-15(11-14)13-22-23-19-10-9-16(25(28)29)12-20(19)32(30,31)24-18-8-3-2-7-17(18)21(26)27/h2-13,23-24H,1H3,(H,26,27)