3-(3-thiophen-2-ylpropanoylamino)benzoic acid

Systemtic Name: 3-(3-thiophen-2-ylpropanoylamino)benzoic acid Openeye Name: 3-[3-(2-thienyl)propanoylamino]benzoic acid CAS Name: 3-[(1-oxo-3-thiophen-2-ylpropyl)amino]benzoic acid IUPAC Name: 3-(3-thiophen-2-ylpropanoylamino)benzoic acid Traditional Name: 3-[3-(2-thienyl)propanoylamino]benzoic acid Formula: C14H13NO3S MolecularWeight: 275.32292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCC2=CC=CS2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCC2=CC=CS2)C(=O)O

InChI

InChI=1S/C14H13NO3S/c16-13(7-6-12-5-2-8-19-12)15-11-4-1-3-10(9-11)14(17)18/h1-5,8-9H,6-7H2,(H,15,16)(H,17,18)