(1R)-6,7-dimethoxy-N-[(2S)-1-oxidanylidene-1-(pyridin-3-ylmethylamino)propan-2-yl]-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: (1R)-6,7-dimethoxy-N-[(2S)-1-oxidanylidene-1-(pyridin-3-ylmethylamino)propan-2-yl]-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: (1R)-6,7-dimethoxy-N-[(1S)-1-methyl-2-oxo-2-(3-pyridylmethylamino)ethyl]-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: (1R)-6,7-dimethoxy-N-[(2S)-1-oxo-1-(3-pyridinylmethylamino)propan-2-yl]-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: (1R)-6,7-dimethoxy-N-[(2S)-1-oxo-1-(pyridin-3-ylmethylamino)propan-2-yl]-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: (1R)-N-[(1S)-2-keto-1-methyl-2-(3-pyridylmethylamino)ethyl]-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CN=CC=C1)NC(=O)N2CCC3=CC(=C(C=C3C2C4=CC=CC=C4)OC)OC

Isomeric SMILES

C[C@@H](C(=O)NCC1=CN=CC=C1)NC(=O)N2CCC3=CC(=C(C=C3[C@H]2C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C27H30N4O4/c1-18(26(32)29-17-19-8-7-12-28-16-19)30-27(33)31-13-11-21-14-23(34-2)24(35-3)15-22(21)25(31)20-9-5-4-6-10-20/h4-10,12,14-16,18,25H,11,13,17H2,1-3H3,(H,29,32)(H,30,33)/t18-,25+/m0/s1