4-[[4-[(2Z)-2-(3-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]amino]-N-methylsulfonyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[4-[(2Z)-2-(3-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]amino]-N-methylsulfonyl-3-nitro-benzenesulfonamide Openeye Name: 4-[4-[(2Z)-2-(3-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]anilino]-N-methylsulfonyl-3-nitro-benzenesulfonamide CAS Name: 4-[4-[(2Z)-2-(3-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]anilino]-N-methylsulfonyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-[(2Z)-2-(3-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]anilino]-N-methylsulfonyl-3-nitrobenzenesulfonamide Traditional Name: 4-[4-[(N'Z)-N'-(4-keto-3-methyl-cyclohexa-2,5-dien-1-ylidene)hydrazino]anilino]-N-mesyl-3-nitro-benzenesulfonamide Formula: C20H19N5O7S2 MolecularWeight: 505.52416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NNC2=CC=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)NS(=O)(=O)C)[N+](=O)[O-])C=CC1=O

Isomeric SMILES

CC1=C/C(=N\NC2=CC=C(C=C2)NC3=C(C=C(C=C3)S(=O)(=O)NS(=O)(=O)C)[N+](=O)[O-])/C=CC1=O

InChI

InChI=1S/C20H19N5O7S2/c1-13-11-16(7-10-20(13)26)23-22-15-5-3-14(4-6-15)21-18-9-8-17(12-19(18)25(27)28)34(31,32)24-33(2,29)30/h3-12,21-22,24H,1-2H3/b23-16-