[2,8-bis(trifluoromethyl)quinolin-4-yl]methyl 2-pyridin-2-ylbutanoate

Systemtic Name: [2,8-bis(trifluoromethyl)quinolin-4-yl]methyl 2-pyridin-2-ylbutanoate Openeye Name: [2,8-bis(trifluoromethyl)-4-quinolyl]methyl 2-(2-pyridyl)butanoate CAS Name: 2-(2-pyridinyl)butanoic acid [2,8-bis(trifluoromethyl)-4-quinolinyl]methyl ester IUPAC Name: [2,8-bis(trifluoromethyl)quinolin-4-yl]methyl 2-pyridin-2-ylbutanoate Traditional Name: 2-(2-pyridyl)butyric acid [2,8-bis(trifluoromethyl)-4-quinolyl]methyl ester Formula: C21H16F6N2O2 MolecularWeight: 442.354359

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=N1)C(=O)OCC2=CC(=NC3=C2C=CC=C3C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCC(C1=CC=CC=N1)C(=O)OCC2=CC(=NC3=C2C=CC=C3C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C21H16F6N2O2/c1-2-13(16-8-3-4-9-28-16)19(30)31-11-12-10-17(21(25,26)27)29-18-14(12)6-5-7-15(18)20(22,23)24/h3-10,13H,2,11H2,1H3