methyl 4-[2-(3,4-dimethoxyphenyl)ethanoylamino]-2,3-dihydrothiophene-5-carboxylate

Systemtic Name: methyl 4-[2-(3,4-dimethoxyphenyl)ethanoylamino]-2,3-dihydrothiophene-5-carboxylate Openeye Name: methyl 4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-2,3-dihydrothiophene-5-carboxylate CAS Name: 4-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]-2,3-dihydrothiophene-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-2,3-dihydrothiophene-5-carboxylate Traditional Name: 4-(homoveratroylamino)-2,3-dihydrothiophene-5-carboxylic acid methyl ester Formula: C16H19NO5S MolecularWeight: 337.39076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2=C(SCC2)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2=C(SCC2)C(=O)OC)OC

InChI

InChI=1S/C16H19NO5S/c1-20-12-5-4-10(8-13(12)21-2)9-14(18)17-11-6-7-23-15(11)16(19)22-3/h4-5,8H,6-7,9H2,1-3H3,(H,17,18)