2-[1-[(3,4-dimethoxyphenyl)methyl]-8-methoxy-5-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-8-methoxy-5-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-5-hydroxy-8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(2-pyridylmethyl)acetamide CAS Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-5-hydroxy-8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-[1-[(3,4-dimethoxyphenyl)methyl]-5-hydroxy-8-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-(5-hydroxy-8-methoxy-1-veratryl-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-pyridylmethyl)acetamide Formula: C27H31N3O5 MolecularWeight: 477.55214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2C3=C(C=CC(=C3CCN2CC(=O)NCC4=CC=CC=N4)O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2C3=C(C=CC(=C3CCN2CC(=O)NCC4=CC=CC=N4)O)OC)OC

InChI

InChI=1S/C27H31N3O5/c1-33-23-9-7-18(15-25(23)35-3)14-21-27-20(22(31)8-10-24(27)34-2)11-13-30(21)17-26(32)29-16-19-6-4-5-12-28-19/h4-10,12,15,21,31H,11,13-14,16-17H2,1-3H3,(H,29,32)