N-(3-chloranyl-2,6-diethyl-phenyl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-chloro-2,6-diethyl-phenyl)acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-chloro-2,6-diethylphenyl)acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-chloro-2,6-diethylphenyl)acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(3-chloro-2,6-diethyl-phenyl)acetamide Formula: C23H25ClN2O2 MolecularWeight: 396.9098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CC2C3=CC=CC=C3C=CN2C(=O)C

InChI

InChI=1S/C23H25ClN2O2/c1-4-16-10-11-20(24)18(5-2)23(16)25-22(28)14-21-19-9-7-6-8-17(19)12-13-26(21)15(3)27/h6-13,21H,4-5,14H2,1-3H3,(H,25,28)