N-(2,4-dimethylphenyl)-5-nitro-2-[2-[(5-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide

Systemtic Name: N-(2,4-dimethylphenyl)-5-nitro-2-[2-[(5-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]benzenesulfonamide Openeye Name: N-(2,4-dimethylphenyl)-2-[2-[(5-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-5-nitro-benzenesulfonamide CAS Name: N-(2,4-dimethylphenyl)-2-[(5-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylhydrazo]-5-nitrobenzenesulfonamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[2-[(5-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-5-nitrobenzenesulfonamide Traditional Name: N-(2,4-dimethylphenyl)-2-[N'-[(5-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-5-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=C(C=CC(=C2)[N+](=O)[O-])NNC=C3C=CC=C(C3=O)O)C

Isomeric SMILES

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

InChI

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