3-(4-thiophen-2-ylbutanoylamino)benzoate

Systemtic Name: 3-(4-thiophen-2-ylbutanoylamino)benzoate Openeye Name: 3-[4-(2-thienyl)butanoylamino]benzoate CAS Name: 3-[(1-oxo-4-thiophen-2-ylbutyl)amino]benzoate IUPAC Name: 3-(4-thiophen-2-ylbutanoylamino)benzoate Traditional Name: 3-[4-(2-thienyl)butanoylamino]benzoate Formula: C15H14NO3S- MolecularWeight: 288.34156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCC2=CC=CS2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCC2=CC=CS2)C(=O)[O-]

InChI

InChI=1S/C15H15NO3S/c17-14(8-2-6-13-7-3-9-20-13)16-12-5-1-4-11(10-12)15(18)19/h1,3-5,7,9-10H,2,6,8H2,(H,16,17)(H,18,19)/p-1