3-[(disulfoamino)-phenyl-amino]benzenesulfonic acid

Systemtic Name: 3-[(disulfoamino)-phenyl-amino]benzenesulfonic acid Openeye Name: 3-(N-(disulfoamino)anilino)benzenesulfonic acid CAS Name: 3-(N-(disulfoamino)anilino)benzenesulfonic acid IUPAC Name: 3-(N-(disulfoamino)anilino)benzenesulfonic acid Traditional Name: 3-(N-(disulfoamino)anilino)besylic acid Formula: C12H12N2O9S3 MolecularWeight: 424.42668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O9S3/c15-24(16,17)12-8-4-7-11(9-12)13(10-5-2-1-3-6-10)14(25(18,19)20)26(21,22)23/h1-9H,(H,15,16,17)(H,18,19,20)(H,21,22,23)