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

Systemtic Name: ethyl 2-(chloromethyl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylate Openeye Name: ethyl 2-(chloromethyl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylate CAS Name: 2-(chloromethyl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(chloromethyl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylate Traditional Name: 2-(chloromethyl)-4-keto-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C14H11ClF3NO3 MolecularWeight: 333.69025

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1=O)C=CC=C2C(F)(F)F)CCl

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1=O)C=CC=C2C(F)(F)F)CCl

InChI

InChI=1S/C14H11ClF3NO3/c1-2-22-13(21)10-9(6-15)19-11-7(12(10)20)4-3-5-8(11)14(16,17)18/h3-5H,2,6H2,1H3,(H,19,20)