2-[8-bromanyl-1-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-quinolin-6-yl]ethanoate

Systemtic Name: 2-[8-bromanyl-1-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-quinolin-6-yl]ethanoate Openeye Name: 2-[8-bromo-1-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-quinolin-6-yl]acetate CAS Name: 2-[8-bromo-1-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-quinolin-6-yl]acetate IUPAC Name: 2-[8-bromo-1-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-quinolin-6-yl]acetate Traditional Name: 2-[8-bromo-1-methyl-2-(trifluoromethyl)-3,4-dihydro-2H-quinolin-6-yl]acetate Formula: C13H12BrF3NO2- MolecularWeight: 351.13909

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CCC2=CC(=CC(=C21)Br)CC(=O)[O-])C(F)(F)F

Isomeric SMILES

CN1C(CCC2=CC(=CC(=C21)Br)CC(=O)[O-])C(F)(F)F

InChI

InChI=1S/C13H13BrF3NO2/c1-18-10(13(15,16)17)3-2-8-4-7(6-11(19)20)5-9(14)12(8)18/h4-5,10H,2-3,6H2,1H3,(H,19,20)/p-1