[2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid [2-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid [2-keto-2-(2-thenoylamino)ethyl] ester Formula: C19H21NO7S MolecularWeight: 407.43754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC(=O)NC(=O)C2=CC=CS2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC(=O)NC(=O)C2=CC=CS2

InChI

InChI=1S/C19H21NO7S/c1-24-13-9-12(10-14(25-2)18(13)26-3)6-7-17(22)27-11-16(21)20-19(23)15-5-4-8-28-15/h4-5,8-10H,6-7,11H2,1-3H3,(H,20,21,23)