4-[(2E)-2-(3,5-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzenesulfonic acid

Systemtic Name: 4-[(2E)-2-(3,5-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzenesulfonic acid Openeye Name: 4-[(2E)-2-(3,5-dimethyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)hydrazino]benzenesulfonic acid CAS Name: 4-[(2E)-2-(3,5-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)hydrazinyl]benzenesulfonic acid IUPAC Name: 4-[(2E)-2-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]benzenesulfonic acid Traditional Name: 4-[(N'E)-N'-(6-keto-3,5-dimethyl-cyclohexa-2,4-dien-1-ylidene)hydrazino]besylic acid Formula: C14H14N2O4S MolecularWeight: 306.33696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NNC2=CC=C(C=C2)S(=O)(=O)O)C(=O)C(=C1)C

Isomeric SMILES

CC1=C/C(=N\NC2=CC=C(C=C2)S(=O)(=O)O)/C(=O)C(=C1)C

InChI

InChI=1S/C14H14N2O4S/c1-9-7-10(2)14(17)13(8-9)16-15-11-3-5-12(6-4-11)21(18,19)20/h3-8,15H,1-2H3,(H,18,19,20)/b16-13+