2-oxidanyl-5-(4-oxidanyl-3-sulfo-phenyl)sulfanyl-benzenesulfonic acid

Systemtic Name: 2-oxidanyl-5-(4-oxidanyl-3-sulfo-phenyl)sulfanyl-benzenesulfonic acid Openeye Name: 2-hydroxy-5-(4-hydroxy-3-sulfo-phenyl)sulfanyl-benzenesulfonic acid CAS Name: 2-hydroxy-5-[(4-hydroxy-3-sulfophenyl)thio]benzenesulfonic acid IUPAC Name: 2-hydroxy-5-(4-hydroxy-3-sulfophenyl)sulfanylbenzenesulfonic acid Traditional Name: 2-hydroxy-5-[(4-hydroxy-3-sulfo-phenyl)thio]besylic acid Formula: C12H10O8S3 MolecularWeight: 378.398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SC2=CC(=C(C=C2)O)S(=O)(=O)O)S(=O)(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1SC2=CC(=C(C=C2)O)S(=O)(=O)O)S(=O)(=O)O)O

InChI

InChI=1S/C12H10O8S3/c13-9-3-1-7(5-11(9)22(15,16)17)21-8-2-4-10(14)12(6-8)23(18,19)20/h1-6,13-14H,(H,15,16,17)(H,18,19,20)