N-[[5-(4-ethoxyphenyl)isoquinolin-8-yl]methyl]-4-ethyl-benzamide

Systemtic Name: N-[[5-(4-ethoxyphenyl)isoquinolin-8-yl]methyl]-4-ethyl-benzamide Openeye Name: N-[[5-(4-ethoxyphenyl)-8-isoquinolyl]methyl]-4-ethyl-benzamide CAS Name: N-[[5-(4-ethoxyphenyl)-8-isoquinolinyl]methyl]-4-ethylbenzamide IUPAC Name: N-[[5-(4-ethoxyphenyl)isoquinolin-8-yl]methyl]-4-ethylbenzamide Traditional Name: 4-ethyl-N-[(5-p-phenetyl-8-isoquinolyl)methyl]benzamide Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NCC2=C3C=NC=CC3=C(C=C2)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C27H26N2O2/c1-3-19-5-7-21(8-6-19)27(30)29-17-22-11-14-24(25-15-16-28-18-26(22)25)20-9-12-23(13-10-20)31-4-2/h5-16,18H,3-4,17H2,1-2H3,(H,29,30)