2-(2-bromophenyl)-5,7-bis(trifluoromethyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(2-bromophenyl)-5,7-bis(trifluoromethyl)quinoline-4-carboxylic acid Openeye Name: 2-(2-bromophenyl)-5,7-bis(trifluoromethyl)quinoline-4-carboxylic acid CAS Name: 2-(2-bromophenyl)-5,7-bis(trifluoromethyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(2-bromophenyl)-5,7-bis(trifluoromethyl)quinoline-4-carboxylic acid Traditional Name: 2-(2-bromophenyl)-5,7-bis(trifluoromethyl)cinchoninic acid Formula: C18H8BrF6NO2 MolecularWeight: 464.156039

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=CC(=CC(=C3C(=C2)C(=O)O)C(F)(F)F)C(F)(F)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=CC(=CC(=C3C(=C2)C(=O)O)C(F)(F)F)C(F)(F)F)Br

InChI

InChI=1S/C18H8BrF6NO2/c19-12-4-2-1-3-9(12)13-7-10(16(27)28)15-11(18(23,24)25)5-8(17(20,21)22)6-14(15)26-13/h1-7H,(H,27,28)