4-methyl-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]benzoic acid

Systemtic Name: 4-methyl-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]benzoic acid Openeye Name: 3-[(2-hydroxy-2-phenyl-acetyl)amino]-4-methyl-benzoic acid CAS Name: 3-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-4-methylbenzoic acid IUPAC Name: 3-[(2-hydroxy-2-phenylacetyl)amino]-4-methylbenzoic acid Traditional Name: 3-(mandeloylamino)-4-methyl-benzoic acid Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C(C2=CC=CC=C2)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C(C2=CC=CC=C2)O

InChI

InChI=1S/C16H15NO4/c1-10-7-8-12(16(20)21)9-13(10)17-15(19)14(18)11-5-3-2-4-6-11/h2-9,14,18H,1H3,(H,17,19)(H,20,21)