[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 3-(3,4-dimethoxyphenyl)propanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-(3,4-dimethoxyphenyl)propanoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)propionic acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)OCC(=O)NCC2=CC=CS2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)OCC(=O)NCC2=CC=CS2)OC

InChI

InChI=1S/C18H21NO5S/c1-22-15-7-5-13(10-16(15)23-2)6-8-18(21)24-12-17(20)19-11-14-4-3-9-25-14/h3-5,7,9-10H,6,8,11-12H2,1-2H3,(H,19,20)