2-[1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-(6-methoxy-1-veratryl-3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-pyridylmethyl)acetamide Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(N(CC2)CC(=O)NCC3=CC=NC=C3)CC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)C(N(CC2)CC(=O)NCC3=CC=NC=C3)CC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H31N3O4/c1-32-22-5-6-23-21(16-22)10-13-30(18-27(31)29-17-19-8-11-28-12-9-19)24(23)14-20-4-7-25(33-2)26(15-20)34-3/h4-9,11-12,15-16,24H,10,13-14,17-18H2,1-3H3,(H,29,31)