methyl 2-bromanyl-3-[7-[[2-(trifluoromethyl)phenyl]methoxy]quinolin-3-yl]propanoate

Systemtic Name: methyl 2-bromanyl-3-[7-[[2-(trifluoromethyl)phenyl]methoxy]quinolin-3-yl]propanoate Openeye Name: methyl 2-bromo-3-[7-[[2-(trifluoromethyl)phenyl]methoxy]-3-quinolyl]propanoate CAS Name: 2-bromo-3-[7-[[2-(trifluoromethyl)phenyl]methoxy]-3-quinolinyl]propanoic acid methyl ester IUPAC Name: methyl 2-bromo-3-[7-[[2-(trifluoromethyl)phenyl]methoxy]quinolin-3-yl]propanoate Traditional Name: 2-bromo-3-[7-[2-(trifluoromethyl)benzyl]oxy-3-quinolyl]propionic acid methyl ester Formula: C21H17BrF3NO3 MolecularWeight: 468.26379

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN=C2C=C(C=CC2=C1)OCC3=CC=CC=C3C(F)(F)F)Br

Isomeric SMILES

COC(=O)C(CC1=CN=C2C=C(C=CC2=C1)OCC3=CC=CC=C3C(F)(F)F)Br

InChI

InChI=1S/C21H17BrF3NO3/c1-28-20(27)18(22)9-13-8-14-6-7-16(10-19(14)26-11-13)29-12-15-4-2-3-5-17(15)21(23,24)25/h2-8,10-11,18H,9,12H2,1H3