3-(3-aminophenyl)-2-sulfooxy-benzoic acid

Systemtic Name: 3-(3-aminophenyl)-2-sulfooxy-benzoic acid Openeye Name: 3-(3-aminophenyl)-2-sulfooxy-benzoic acid CAS Name: 3-(3-aminophenyl)-2-sulfooxybenzoic acid IUPAC Name: 3-(3-aminophenyl)-2-sulfooxybenzoic acid Traditional Name: 3-(3-aminophenyl)-2-sulfoxy-benzoic acid Formula: C13H11NO6S MolecularWeight: 309.29454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11NO6S/c14-9-4-1-3-8(7-9)10-5-2-6-11(13(15)16)12(10)20-21(17,18)19/h1-7H,14H2,(H,15,16)(H,17,18,19)