2-[1-[(3,4-dimethylphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-pyridin-3-yl-ethanamide

Systemtic Name: 2-[1-[(3,4-dimethylphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-pyridin-3-yl-ethanamide Openeye Name: 2-[1-[(3,4-dimethylphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(3-pyridyl)acetamide CAS Name: 2-[1-[(3,4-dimethylphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(3-pyridinyl)acetamide IUPAC Name: 2-[1-[(3,4-dimethylphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-pyridin-3-ylacetamide Traditional Name: 2-[1-(3,4-dimethylbenzyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]-N-(3-pyridyl)acetamide Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2CC(=O)NC4=CN=CC=C4)OC)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2CC(=O)NC4=CN=CC=C4)OC)OC)C

InChI

InChI=1S/C27H31N3O3/c1-18-7-8-20(12-19(18)2)13-24-23-15-26(33-4)25(32-3)14-21(23)9-11-30(24)17-27(31)29-22-6-5-10-28-16-22/h5-8,10,12,14-16,24H,9,11,13,17H2,1-4H3,(H,29,31)