2-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl N-quinolin-4-ylcarbamate

Systemtic Name: 2-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl N-quinolin-4-ylcarbamate Openeye Name: 2-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl N-(4-quinolyl)carbamate CAS Name: N-(4-quinolinyl)carbamic acid 2-[6,7-dimethoxy-1-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethyl ester IUPAC Name: 2-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl N-quinolin-4-ylcarbamate Traditional Name: N-(4-quinolyl)carbamic acid 2-(1-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl ester Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CCOC(=O)NC3=CC=NC4=CC=CC=C43)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CCOC(=O)NC3=CC=NC4=CC=CC=C43)CC5=CC=CC=C5)OC

InChI

InChI=1S/C30H31N3O4/c1-35-28-19-22-13-15-33(27(24(22)20-29(28)36-2)18-21-8-4-3-5-9-21)16-17-37-30(34)32-26-12-14-31-25-11-7-6-10-23(25)26/h3-12,14,19-20,27H,13,15-18H2,1-2H3,(H,31,32,34)