N-[isoquinolin-1-yl(phenyl)methyl]-N-phenyl-benzamide

Systemtic Name: N-[isoquinolin-1-yl(phenyl)methyl]-N-phenyl-benzamide Openeye Name: N-[1-isoquinolyl(phenyl)methyl]-N-phenyl-benzamide CAS Name: N-[1-isoquinolinyl(phenyl)methyl]-N-phenylbenzamide IUPAC Name: N-[isoquinolin-1-yl(phenyl)methyl]-N-phenylbenzamide Traditional Name: N-[1-isoquinolyl(phenyl)methyl]-N-phenyl-benzamide Formula: C29H22N2O MolecularWeight: 414.49778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=NC=CC3=CC=CC=C32)N(C4=CC=CC=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C2=NC=CC3=CC=CC=C32)N(C4=CC=CC=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H22N2O/c32-29(24-15-6-2-7-16-24)31(25-17-8-3-9-18-25)28(23-13-4-1-5-14-23)27-26-19-11-10-12-22(26)20-21-30-27/h1-21,28H