3-[[5-methoxy-2-methyl-4-[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]diazenyl]benzenesulfonic acid

Systemtic Name: 3-[[5-methoxy-2-methyl-4-[2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]diazenyl]benzenesulfonic acid Openeye Name: 3-[5-methoxy-2-methyl-4-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)hydrazino]phenyl]azobenzenesulfonic acid CAS Name: 3-[5-methoxy-2-methyl-4-[2-(4-oxo-1-cyclohexa-2,5-dienylidene)hydrazinyl]phenyl]azobenzenesulfonic acid IUPAC Name: 3-[[5-methoxy-2-methyl-4-[2-(4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]phenyl]diazenyl]benzenesulfonic acid Traditional Name: 3-[4-[N'-(4-ketocyclohexa-2,5-dien-1-ylidene)hydrazino]-5-methoxy-2-methyl-phenyl]azobesylic acid Formula: C20H18N4O5S MolecularWeight: 426.44572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N=NC2=CC(=CC=C2)S(=O)(=O)O)OC)NN=C3C=CC(=O)C=C3

Isomeric SMILES

CC1=CC(=C(C=C1N=NC2=CC(=CC=C2)S(=O)(=O)O)OC)NN=C3C=CC(=O)C=C3

InChI

InChI=1S/C20H18N4O5S/c1-13-10-19(24-21-14-6-8-16(25)9-7-14)20(29-2)12-18(13)23-22-15-4-3-5-17(11-15)30(26,27)28/h3-12,24H,1-2H3,(H,26,27,28)