3-[(4-aminophenyl)carbonylamino]-2-oxidanyl-5-sulfo-benzoic acid

Systemtic Name: 3-[(4-aminophenyl)carbonylamino]-2-oxidanyl-5-sulfo-benzoic acid Openeye Name: 3-[(4-aminobenzoyl)amino]-2-hydroxy-5-sulfo-benzoic acid CAS Name: 3-[[(4-aminophenyl)-oxomethyl]amino]-2-hydroxy-5-sulfobenzoic acid IUPAC Name: 3-[(4-aminobenzoyl)amino]-2-hydroxy-5-sulfobenzoic acid Traditional Name: 3-[(4-aminobenzoyl)amino]-2-hydroxy-5-sulfo-benzoic acid Formula: C14H12N2O7S MolecularWeight: 352.31928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(C(=CC(=C2)S(=O)(=O)O)C(=O)O)O)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(C(=CC(=C2)S(=O)(=O)O)C(=O)O)O)N

InChI

InChI=1S/C14H12N2O7S/c15-8-3-1-7(2-4-8)13(18)16-11-6-9(24(21,22)23)5-10(12(11)17)14(19)20/h1-6,17H,15H2,(H,16,18)(H,19,20)(H,21,22,23)