N-[(4-tert-butylphenyl)methyl]-2-isoquinolin-5-yl-ethanamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-2-isoquinolin-5-yl-ethanamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-2-(5-isoquinolyl)acetamide CAS Name: N-[(4-tert-butylphenyl)methyl]-2-(5-isoquinolinyl)acetamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-2-isoquinolin-5-ylacetamide Traditional Name: N-(4-tert-butylbenzyl)-2-(5-isoquinolyl)acetamide Formula: C22H24N2O MolecularWeight: 332.43876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=O)CC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=O)CC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C22H24N2O/c1-22(2,3)19-9-7-16(8-10-19)14-24-21(25)13-17-5-4-6-18-15-23-12-11-20(17)18/h4-12,15H,13-14H2,1-3H3,(H,24,25)