4-[(5-sulfocyclohexa-1,5-dien-1-yl)diazenyl]benzenesulfonic acid

Systemtic Name: 4-[(5-sulfocyclohexa-1,5-dien-1-yl)diazenyl]benzenesulfonic acid Openeye Name: 4-(5-sulfocyclohexa-1,5-dien-1-yl)azobenzenesulfonic acid CAS Name: 4-[(5-sulfo-1-cyclohexa-1,5-dienyl)azo]benzenesulfonic acid IUPAC Name: 4-[(5-sulfocyclohexa-1,5-dien-1-yl)diazenyl]benzenesulfonic acid Traditional Name: 4-(5-sulfocyclohexa-1,5-dien-1-yl)azobesylic acid Formula: C12H12N2O6S2 MolecularWeight: 344.36348

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1CC(=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C12H12N2O6S2/c15-21(16,17)11-6-4-9(5-7-11)13-14-10-2-1-3-12(8-10)22(18,19)20/h2,4-8H,1,3H2,(H,15,16,17)(H,18,19,20)