N-[(2,4-dimethylphenyl)methyl]-2-isoquinolin-5-yl-propanamide

Systemtic Name: N-[(2,4-dimethylphenyl)methyl]-2-isoquinolin-5-yl-propanamide Openeye Name: N-[(2,4-dimethylphenyl)methyl]-2-(5-isoquinolyl)propanamide CAS Name: N-[(2,4-dimethylphenyl)methyl]-2-(5-isoquinolinyl)propanamide IUPAC Name: N-[(2,4-dimethylphenyl)methyl]-2-isoquinolin-5-ylpropanamide Traditional Name: N-(2,4-dimethylbenzyl)-2-(5-isoquinolyl)propionamide Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CNC(=O)C(C)C2=CC=CC3=C2C=CN=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CNC(=O)C(C)C2=CC=CC3=C2C=CN=C3)C

InChI

InChI=1S/C21H22N2O/c1-14-7-8-17(15(2)11-14)13-23-21(24)16(3)19-6-4-5-18-12-22-10-9-20(18)19/h4-12,16H,13H2,1-3H3,(H,23,24)