3-[(1-azanyl-3,6-dimethoxy-cyclohexa-2,4-dien-1-yl)diazenyl]-4-methoxy-benzenesulfonic acid

Systemtic Name: 3-[(1-azanyl-3,6-dimethoxy-cyclohexa-2,4-dien-1-yl)diazenyl]-4-methoxy-benzenesulfonic acid Openeye Name: 3-(1-amino-3,6-dimethoxy-cyclohexa-2,4-dien-1-yl)azo-4-methoxy-benzenesulfonic acid CAS Name: 3-[(1-amino-3,6-dimethoxy-1-cyclohexa-2,4-dienyl)azo]-4-methoxybenzenesulfonic acid IUPAC Name: 3-[(1-amino-3,6-dimethoxycyclohexa-2,4-dien-1-yl)diazenyl]-4-methoxybenzenesulfonic acid Traditional Name: 3-(1-amino-3,6-dimethoxy-cyclohexa-2,4-dien-1-yl)azo-4-methoxy-besylic acid Formula: C15H19N3O6S MolecularWeight: 369.39286

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Descriptors Computed from Structure

Canonical SMILES:

COC1C=CC(=CC1(N)N=NC2=C(C=CC(=C2)S(=O)(=O)O)OC)OC

Isomeric SMILES

COC1C=CC(=CC1(N)N=NC2=C(C=CC(=C2)S(=O)(=O)O)OC)OC

InChI

InChI=1S/C15H19N3O6S/c1-22-10-4-7-14(24-3)15(16,9-10)18-17-12-8-11(25(19,20)21)5-6-13(12)23-2/h4-9,14H,16H2,1-3H3,(H,19,20,21)