N-[(2,4-dichlorophenyl)methyl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-methyl-ethanamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-methyl-ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[(2,4-dichlorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[(2,4-dichlorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[(2,4-dichlorophenyl)methyl]-N-methylacetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(2,4-dichlorobenzyl)-N-methyl-acetamide Formula: C21H20Cl2N2O2 MolecularWeight: 403.3017

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)N(C)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)N(C)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O2/c1-14(26)25-10-9-15-5-3-4-6-18(15)20(25)12-21(27)24(2)13-16-7-8-17(22)11-19(16)23/h3-11,20H,12-13H2,1-2H3