3-oxidanylidene-3-[(2-sulfanylphenyl)amino]propanoic acid

Systemtic Name: 3-oxidanylidene-3-[(2-sulfanylphenyl)amino]propanoic acid Openeye Name: 3-oxo-3-(2-sulfanylanilino)propanoic acid CAS Name: 3-(2-mercaptoanilino)-3-oxopropanoic acid IUPAC Name: 3-oxo-3-(2-sulfanylanilino)propanoic acid Traditional Name: 3-keto-3-(2-mercaptoanilino)propionic acid Formula: C9H9NO3S MolecularWeight: 211.23766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CC(=O)O)S

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CC(=O)O)S

InChI

InChI=1S/C9H9NO3S/c11-8(5-9(12)13)10-6-3-1-2-4-7(6)14/h1-4,14H,5H2,(H,10,11)(H,12,13)