4-[[4-[2-(2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]amino]-3-nitro-benzenesulfonic acid

Systemtic Name: 4-[[4-[2-(2-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]amino]-3-nitro-benzenesulfonic acid Openeye Name: 4-[4-[2-(2-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)hydrazino]anilino]-3-nitro-benzenesulfonic acid CAS Name: 4-[4-[2-(2-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]anilino]-3-nitrobenzenesulfonic acid IUPAC Name: 4-[4-[2-(2-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]anilino]-3-nitrobenzenesulfonic acid Traditional Name: 4-[4-[N'-(4-keto-2-methyl-cyclohexa-2,5-dien-1-ylidene)hydrazino]anilino]-3-nitro-besylic acid Formula: C19H16N4O6S MolecularWeight: 428.41854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N4O6S/c1-12-10-15(24)6-8-17(12)22-21-14-4-2-13(3-5-14)20-18-9-7-16(30(27,28)29)11-19(18)23(25)26/h2-11,20-21H,1H3,(H,27,28,29)