[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)propanoate

Systemtic Name: [2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)propanoate Openeye Name: [2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl] 3-(2-chlorophenyl)propanoate CAS Name: 3-(2-chlorophenyl)propanoic acid [2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3-(2-chlorophenyl)propanoate Traditional Name: 3-(2-chlorophenyl)propionic acid [2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl] ester Formula: C22H24ClNO5 MolecularWeight: 417.88266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)COC(=O)CCC3=CC=CC=C3Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)COC(=O)CCC3=CC=CC=C3Cl)OC

InChI

InChI=1S/C22H24ClNO5/c1-27-19-11-16-9-10-24(13-17(16)12-20(19)28-2)21(25)14-29-22(26)8-7-15-5-3-4-6-18(15)23/h3-6,11-12H,7-10,13-14H2,1-2H3