N-[[5-(3,4-dimethoxyphenyl)isoquinolin-8-yl]methyl]-2-phenyl-ethanamide

Systemtic Name: N-[[5-(3,4-dimethoxyphenyl)isoquinolin-8-yl]methyl]-2-phenyl-ethanamide Openeye Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolyl]methyl]-2-phenyl-acetamide CAS Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolinyl]methyl]-2-phenylacetamide IUPAC Name: N-[[5-(3,4-dimethoxyphenyl)isoquinolin-8-yl]methyl]-2-phenylacetamide Traditional Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolyl]methyl]-2-phenyl-acetamide Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)CC4=CC=CC=C4)OC

InChI

InChI=1S/C26H24N2O3/c1-30-24-11-9-19(15-25(24)31-2)21-10-8-20(23-17-27-13-12-22(21)23)16-28-26(29)14-18-6-4-3-5-7-18/h3-13,15,17H,14,16H2,1-2H3,(H,28,29)