ethyl 2-butyl-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 2-butyl-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylate Openeye Name: ethyl 2-butyl-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylate CAS Name: 2-butyl-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylate Traditional Name: 2-butyl-4-keto-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C17H18F3NO3 MolecularWeight: 341.32493

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C2=C(N1)C(=CC=C2)C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCCCC1=C(C(=O)C2=C(N1)C(=CC=C2)C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C17H18F3NO3/c1-3-5-9-12-13(16(23)24-4-2)15(22)10-7-6-8-11(14(10)21-12)17(18,19)20/h6-8H,3-5,9H2,1-2H3,(H,21,22)