N-(2,5-dimethylphenyl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C21H22N2O2/c1-14-8-9-15(2)19(12-14)22-21(25)13-20-18-7-5-4-6-17(18)10-11-23(20)16(3)24/h4-12,20H,13H2,1-3H3,(H,22,25)