2-[(4-hydroxyphenyl)amino]ethanoic acid; 2-sulfooxybenzoic acid

Systemtic Name: 2-[(4-hydroxyphenyl)amino]ethanoic acid; 2-sulfooxybenzoic acid Openeye Name: 2-(4-hydroxyanilino)acetic acid; 2-sulfooxybenzoic acid CAS Name: 2-(4-hydroxyanilino)acetic acid; 2-sulfooxybenzoic acid IUPAC Name: 2-(4-hydroxyanilino)acetic acid; 2-sulfooxybenzoic acid Traditional Name: 2-(4-hydroxyanilino)acetic acid; 2-sulfoxybenzoic acid Formula: C15H15NO9S MolecularWeight: 385.3459

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)OS(=O)(=O)O.C1=CC(=CC=C1NCC(=O)O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)OS(=O)(=O)O.C1=CC(=CC=C1NCC(=O)O)O

InChI

InChI=1S/C8H9NO3.C7H6O6S/c10-7-3-1-6(2-4-7)9-5-8(11)12;8-7(9)5-3-1-2-4-6(5)13-14(10,11)12/h1-4,9-10H,5H2,(H,11,12);1-4H,(H,8,9)(H,10,11,12)