[3-(trifluoromethyl)phenyl]methyl 2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 2-(2-acetyl-1H-isoquinolin-1-yl)acetate CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)acetic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 2-(2-acetyl-1H-isoquinolin-1-yl)acetate Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)acetic acid [3-(trifluoromethyl)benzyl] ester Formula: C21H18F3NO3 MolecularWeight: 389.36773

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)OCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)OCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H18F3NO3/c1-14(26)25-10-9-16-6-2-3-8-18(16)19(25)12-20(27)28-13-15-5-4-7-17(11-15)21(22,23)24/h2-11,19H,12-13H2,1H3