6,6-bis(azanyl)-3-(3-sulfophenyl)cyclohexa-1,4-diene-1-sulfonic acid

Systemtic Name: 6,6-bis(azanyl)-3-(3-sulfophenyl)cyclohexa-1,4-diene-1-sulfonic acid Openeye Name: 6,6-diamino-3-(3-sulfophenyl)cyclohexa-1,4-diene-1-sulfonic acid CAS Name: 6,6-diamino-3-(3-sulfophenyl)-1-cyclohexa-1,4-dienesulfonic acid IUPAC Name: 6,6-diamino-3-(3-sulfophenyl)cyclohexa-1,4-diene-1-sulfonic acid Traditional Name: 6,6-diamino-3-(3-sulfophenyl)cyclohexa-1,4-diene-1-sulfonic acid Formula: C12H14N2O6S2 MolecularWeight: 346.37936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)C2C=CC(C(=C2)S(=O)(=O)O)(N)N

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)C2C=CC(C(=C2)S(=O)(=O)O)(N)N

InChI

InChI=1S/C12H14N2O6S2/c13-12(14)5-4-9(7-11(12)22(18,19)20)8-2-1-3-10(6-8)21(15,16)17/h1-7,9H,13-14H2,(H,15,16,17)(H,18,19,20)