ethyl 4-[4-(trifluoromethyl)isoquinolin-3-yl]benzoate

Systemtic Name: ethyl 4-[4-(trifluoromethyl)isoquinolin-3-yl]benzoate Openeye Name: ethyl 4-[4-(trifluoromethyl)-3-isoquinolyl]benzoate CAS Name: 4-[4-(trifluoromethyl)-3-isoquinolinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(trifluoromethyl)isoquinolin-3-yl]benzoate Traditional Name: 4-[4-(trifluoromethyl)-3-isoquinolyl]benzoic acid ethyl ester Formula: C19H14F3NO2 MolecularWeight: 345.31517

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C=N2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=C(C3=CC=CC=C3C=N2)C(F)(F)F

InChI

InChI=1S/C19H14F3NO2/c1-2-25-18(24)13-9-7-12(8-10-13)17-16(19(20,21)22)15-6-4-3-5-14(15)11-23-17/h3-11H,2H2,1H3