ethyl 2-[2-(3,4-dimethoxyphenyl)ethanoylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3,4-dimethoxyphenyl)ethanoylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-(homoveratroylamino)benzothiophene-3-carboxylic acid ethyl ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H21NO5S/c1-4-27-21(24)19-14-7-5-6-8-17(14)28-20(19)22-18(23)12-13-9-10-15(25-2)16(11-13)26-3/h5-11H,4,12H2,1-3H3,(H,22,23)