N-isoquinolin-5-yl-3-[4-(2-methylbutan-2-yl)phenyl]propanamide

Systemtic Name: N-isoquinolin-5-yl-3-[4-(2-methylbutan-2-yl)phenyl]propanamide Openeye Name: 3-[4-(1,1-dimethylpropyl)phenyl]-N-(5-isoquinolyl)propanamide CAS Name: N-(5-isoquinolinyl)-3-[4-(2-methylbutan-2-yl)phenyl]propanamide IUPAC Name: N-isoquinolin-5-yl-3-[4-(2-methylbutan-2-yl)phenyl]propanamide Traditional Name: 3-(4-tert-amylphenyl)-N-(5-isoquinolyl)propionamide Formula: C23H26N2O MolecularWeight: 346.46534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)CCC(=O)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)CCC(=O)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C23H26N2O/c1-4-23(2,3)19-11-8-17(9-12-19)10-13-22(26)25-21-7-5-6-18-16-24-15-14-20(18)21/h5-9,11-12,14-16H,4,10,13H2,1-3H3,(H,25,26)