methyl 5-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]thiophene-2-carboxylate

Systemtic Name: methyl 5-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]thiophene-2-carboxylate Openeye Name: methyl 5-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)thiophene-2-carboxylate CAS Name: 5-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)thiophene-2-carboxylate Traditional Name: 5-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)thiophene-2-carboxylic acid methyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=C(S3)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=C(S3)C(=O)OC)OCC

InChI

InChI=1S/C20H23NO5S/c1-4-25-15-10-13-8-9-21(12-14(13)11-16(15)26-5-2)19(22)17-6-7-18(27-17)20(23)24-3/h6-7,10-11H,4-5,8-9,12H2,1-3H3