3-methyl-5-[(2-oxidanyl-2-phenyl-ethanoyl)amino]thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-[(2-oxidanyl-2-phenyl-ethanoyl)amino]thiophene-2-carboxylic acid Openeye Name: 5-[(2-hydroxy-2-phenyl-acetyl)amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(2-hydroxy-2-phenylacetyl)amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-(mandeloylamino)-3-methyl-2-thenoic acid Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO4S/c1-8-7-10(20-12(8)14(18)19)15-13(17)11(16)9-5-3-2-4-6-9/h2-7,11,16H,1H3,(H,15,17)(H,18,19)