5-azanyl-2-(4-azanyl-2-sulfo-phenyl)sulfanyl-benzenesulfonic acid

Systemtic Name: 5-azanyl-2-(4-azanyl-2-sulfo-phenyl)sulfanyl-benzenesulfonic acid Openeye Name: 5-amino-2-(4-amino-2-sulfo-phenyl)sulfanyl-benzenesulfonic acid CAS Name: 5-amino-2-[(4-amino-2-sulfophenyl)thio]benzenesulfonic acid IUPAC Name: 5-amino-2-(4-amino-2-sulfophenyl)sulfanylbenzenesulfonic acid Traditional Name: 5-amino-2-[(4-amino-2-sulfo-phenyl)thio]besylic acid Formula: C12H12N2O6S3 MolecularWeight: 376.42848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)S(=O)(=O)O)SC2=C(C=C(C=C2)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)S(=O)(=O)O)SC2=C(C=C(C=C2)N)S(=O)(=O)O

InChI

InChI=1S/C12H12N2O6S3/c13-7-1-3-9(11(5-7)22(15,16)17)21-10-4-2-8(14)6-12(10)23(18,19)20/h1-6H,13-14H2,(H,15,16,17)(H,18,19,20)