N-[1-[4-(aminomethyl)phenyl]isoquinolin-3-yl]-2-(4-phenylphenyl)ethanamide

Systemtic Name: N-[1-[4-(aminomethyl)phenyl]isoquinolin-3-yl]-2-(4-phenylphenyl)ethanamide Openeye Name: N-[1-[4-(aminomethyl)phenyl]-3-isoquinolyl]-2-(4-phenylphenyl)acetamide CAS Name: N-[1-[4-(aminomethyl)phenyl]-3-isoquinolinyl]-2-(4-phenylphenyl)acetamide IUPAC Name: N-[1-[4-(aminomethyl)phenyl]isoquinolin-3-yl]-2-(4-phenylphenyl)acetamide Traditional Name: N-[1-[4-(aminomethyl)phenyl]-3-isoquinolyl]-2-(4-phenylphenyl)acetamide Formula: C30H25N3O MolecularWeight: 443.539

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)NC3=CC4=CC=CC=C4C(=N3)C5=CC=C(C=C5)CN

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)NC3=CC4=CC=CC=C4C(=N3)C5=CC=C(C=C5)CN

InChI

InChI=1S/C30H25N3O/c31-20-22-12-16-25(17-13-22)30-27-9-5-4-8-26(27)19-28(33-30)32-29(34)18-21-10-14-24(15-11-21)23-6-2-1-3-7-23/h1-17,19H,18,20,31H2,(H,32,33,34)