N-[[5-(4-methylphenyl)isoquinolin-8-yl]methyl]-2-phenoxy-ethanamide

Systemtic Name: N-[[5-(4-methylphenyl)isoquinolin-8-yl]methyl]-2-phenoxy-ethanamide Openeye Name: 2-phenoxy-N-[[5-(p-tolyl)-8-isoquinolyl]methyl]acetamide CAS Name: N-[[5-(4-methylphenyl)-8-isoquinolinyl]methyl]-2-phenoxyacetamide IUPAC Name: N-[[5-(4-methylphenyl)isoquinolin-8-yl]methyl]-2-phenoxyacetamide Traditional Name: 2-phenoxy-N-[[5-(p-tolyl)-8-isoquinolyl]methyl]acetamide Formula: C25H22N2O2 MolecularWeight: 382.45438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H22N2O2/c1-18-7-9-19(10-8-18)22-12-11-20(24-16-26-14-13-23(22)24)15-27-25(28)17-29-21-5-3-2-4-6-21/h2-14,16H,15,17H2,1H3,(H,27,28)