8-bromanyl-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: 8-bromanyl-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: 8-bromo-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 8-bromo-6-methyl-4-(trifluoromethyl)-3-quinolinecarboxylate IUPAC Name: 8-bromo-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 8-bromo-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylate Formula: C12H6BrF3NO2- MolecularWeight: 333.08075

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C=N2)C(=O)[O-])C(F)(F)F)Br

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C=N2)C(=O)[O-])C(F)(F)F)Br

InChI

InChI=1S/C12H7BrF3NO2/c1-5-2-6-9(12(14,15)16)7(11(18)19)4-17-10(6)8(13)3-5/h2-4H,1H3,(H,18,19)/p-1