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

Systemtic Name: N-[[5-(3,4-dimethoxyphenyl)isoquinolin-8-yl]methyl]-3-phenyl-propanamide Openeye Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolyl]methyl]-3-phenyl-propanamide CAS Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolinyl]methyl]-3-phenylpropanamide IUPAC Name: N-[[5-(3,4-dimethoxyphenyl)isoquinolin-8-yl]methyl]-3-phenylpropanamide Traditional Name: N-[[5-(3,4-dimethoxyphenyl)-8-isoquinolyl]methyl]-3-phenyl-propionamide Formula: C27H26N2O3 MolecularWeight: 426.50694

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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)CCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)CCC4=CC=CC=C4)OC

InChI

InChI=1S/C27H26N2O3/c1-31-25-12-10-20(16-26(25)32-2)22-11-9-21(24-18-28-15-14-23(22)24)17-29-27(30)13-8-19-6-4-3-5-7-19/h3-7,9-12,14-16,18H,8,13,17H2,1-2H3,(H,29,30)