(1S,2R)-N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]-2-phenyl-cyclopropane-1-carboxamide

Systemtic Name: (1S,2R)-N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]-2-phenyl-cyclopropane-1-carboxamide Openeye Name: (1S,2R)-N-[[5-(3-methoxyphenyl)-8-isoquinolyl]methyl]-2-phenyl-cyclopropanecarboxamide CAS Name: (1S,2R)-N-[[5-(3-methoxyphenyl)-8-isoquinolinyl]methyl]-2-phenyl-1-cyclopropanecarboxamide IUPAC Name: (1S,2R)-N-[[5-(3-methoxyphenyl)isoquinolin-8-yl]methyl]-2-phenylcyclopropane-1-carboxamide Traditional Name: (1S,2R)-N-[[5-(3-methoxyphenyl)-8-isoquinolyl]methyl]-2-phenyl-cyclopropanecarboxamide Formula: C27H24N2O2 MolecularWeight: 408.49166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)C4CC4C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)[C@H]4C[C@H]4C5=CC=CC=C5

InChI

InChI=1S/C27H24N2O2/c1-31-21-9-5-8-19(14-21)22-11-10-20(26-17-28-13-12-23(22)26)16-29-27(30)25-15-24(25)18-6-3-2-4-7-18/h2-14,17,24-25H,15-16H2,1H3,(H,29,30)/t24-,25-/m0/s1