N-(2,4-dimethylphenyl)-3-nitro-4-[2-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide

Systemtic Name: N-(2,4-dimethylphenyl)-3-nitro-4-[2-[(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide Openeye Name: N-(2,4-dimethylphenyl)-4-[2-[(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-3-nitro-benzenesulfonamide CAS Name: N-(2,4-dimethylphenyl)-4-[(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-3-nitrobenzenesulfonamide IUPAC Name: N-(2,4-dimethylphenyl)-4-[2-[(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-nitrobenzenesulfonamide Traditional Name: N-(2,4-dimethylphenyl)-4-[N'-[(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-3-nitro-benzenesulfonamide Formula: C21H20N4O6S MolecularWeight: 456.4717

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NNC=C3C=CC(=O)C(=C3)O)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NNC=C3C=CC(=O)C(=C3)O)[N+](=O)[O-])C

InChI

InChI=1S/C21H20N4O6S/c1-13-3-6-17(14(2)9-13)24-32(30,31)16-5-7-18(19(11-16)25(28)29)23-22-12-15-4-8-20(26)21(27)10-15/h3-12,22-24,27H,1-2H3