methyl 3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]benzoate

Systemtic Name: methyl 3-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)amino]benzoate Openeye Name: methyl 3-[[4-oxo-4-(2-thienyl)butanoyl]amino]benzoate CAS Name: 3-[(1,4-dioxo-4-thiophen-2-ylbutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-oxo-4-thiophen-2-ylbutanoyl)amino]benzoate Traditional Name: 3-[[4-keto-4-(2-thienyl)butanoyl]amino]benzoic acid methyl ester Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)C2=CC=CS2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)C2=CC=CS2

InChI

InChI=1S/C16H15NO4S/c1-21-16(20)11-4-2-5-12(10-11)17-15(19)8-7-13(18)14-6-3-9-22-14/h2-6,9-10H,7-8H2,1H3,(H,17,19)