[2-(3-methyl-1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 3-acetamido-3-thiophen-2-yl-propanoate

Systemtic Name: [2-(3-methyl-1-benzofuran-2-yl)-2-oxidanylidene-ethyl] 3-acetamido-3-thiophen-2-yl-propanoate Openeye Name: [2-(3-methylbenzofuran-2-yl)-2-oxo-ethyl] 3-acetamido-3-(2-thienyl)propanoate CAS Name: 3-acetamido-3-thiophen-2-ylpropanoic acid [2-(3-methyl-2-benzofuranyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methyl-1-benzofuran-2-yl)-2-oxoethyl] 3-acetamido-3-thiophen-2-ylpropanoate Traditional Name: 3-acetamido-3-(2-thienyl)propionic acid [2-keto-2-(3-methylbenzofuran-2-yl)ethyl] ester Formula: C20H19NO5S MolecularWeight: 385.43356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)COC(=O)CC(C3=CC=CS3)NC(=O)C

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)COC(=O)CC(C3=CC=CS3)NC(=O)C

InChI

InChI=1S/C20H19NO5S/c1-12-14-6-3-4-7-17(14)26-20(12)16(23)11-25-19(24)10-15(21-13(2)22)18-8-5-9-27-18/h3-9,15H,10-11H2,1-2H3,(H,21,22)