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

Systemtic Name: N-(1-cyanocyclohexyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-N-methyl-acetamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CN1CCC2=CC(=C(C=C2C1C3=CC=CC=C3)OC)OC)C4(CCCCC4)C#N

Isomeric SMILES

CN(C(=O)CN1CCC2=CC(=C(C=C2[C@H]1C3=CC=CC=C3)OC)OC)C4(CCCCC4)C#N

InChI

InChI=1S/C27H33N3O3/c1-29(27(19-28)13-8-5-9-14-27)25(31)18-30-15-12-21-16-23(32-2)24(33-3)17-22(21)26(30)20-10-6-4-7-11-20/h4,6-7,10-11,16-17,26H,5,8-9,12-15,18H2,1-3H3/t26-/m1/s1