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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NCCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2[C@@H]1CC(=O)NCCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O2/c1-14(26)25-11-9-15-4-2-3-5-18(15)20(25)13-21(27)24-10-8-16-6-7-17(22)12-19(16)23/h2-7,9,11-12,20H,8,10,13H2,1H3,(H,24,27)/t20-/m0/s1