ethyl 4-piperidin-1-yl-2-(trifluoromethyl)quinolin-1-ium-6-carboxylate

Systemtic Name: ethyl 4-piperidin-1-yl-2-(trifluoromethyl)quinolin-1-ium-6-carboxylate Openeye Name: ethyl 4-(1-piperidyl)-2-(trifluoromethyl)quinolin-1-ium-6-carboxylate CAS Name: 4-(1-piperidinyl)-2-(trifluoromethyl)-6-quinolin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-piperidin-1-yl-2-(trifluoromethyl)quinolin-1-ium-6-carboxylate Traditional Name: 4-piperidino-2-(trifluoromethyl)quinolin-1-ium-6-carboxylic acid ethyl ester Formula: C18H20F3N2O2+ MolecularWeight: 353.35881

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)[NH+]=C(C=C2N3CCCCC3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)[NH+]=C(C=C2N3CCCCC3)C(F)(F)F

InChI

InChI=1S/C18H19F3N2O2/c1-2-25-17(24)12-6-7-14-13(10-12)15(23-8-4-3-5-9-23)11-16(22-14)18(19,20)21/h6-7,10-11H,2-5,8-9H2,1H3/p+1