methyl 2-[6,7-dimethoxy-2-[(phenylmethyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: methyl 2-[6,7-dimethoxy-2-[(phenylmethyl)carbamoyl]-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: methyl 2-[2-(benzylcarbamoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[6,7-dimethoxy-2-[oxo-[(phenylmethyl)amino]methyl]-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(benzylcarbamoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[2-(benzylcarbamoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid methyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)NCC3=CC=CC=C3)CC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)NCC3=CC=CC=C3)CC(=O)OC)OC

InChI

InChI=1S/C22H26N2O5/c1-27-19-11-16-9-10-24(22(26)23-14-15-7-5-4-6-8-15)18(13-21(25)29-3)17(16)12-20(19)28-2/h4-8,11-12,18H,9-10,13-14H2,1-3H3,(H,23,26)