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

Systemtic Name: N-[[5-(4-ethoxyphenyl)isoquinolin-8-yl]methyl]-2-phenoxy-ethanamide Openeye Name: N-[[5-(4-ethoxyphenyl)-8-isoquinolyl]methyl]-2-phenoxy-acetamide CAS Name: N-[[5-(4-ethoxyphenyl)-8-isoquinolinyl]methyl]-2-phenoxyacetamide IUPAC Name: N-[[5-(4-ethoxyphenyl)isoquinolin-8-yl]methyl]-2-phenoxyacetamide Traditional Name: 2-phenoxy-N-[(5-p-phenetyl-8-isoquinolyl)methyl]acetamide Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)COC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C3C=CN=CC3=C(C=C2)CNC(=O)COC4=CC=CC=C4

InChI

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