2-(3-bromophenyl)-8-(trifluoromethyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(3-bromophenyl)-8-(trifluoromethyl)quinoline-4-carboxylic acid Openeye Name: 2-(3-bromophenyl)-8-(trifluoromethyl)quinoline-4-carboxylic acid CAS Name: 2-(3-bromophenyl)-8-(trifluoromethyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(3-bromophenyl)-8-(trifluoromethyl)quinoline-4-carboxylic acid Traditional Name: 2-(3-bromophenyl)-8-(trifluoromethyl)cinchoninic acid Formula: C17H9BrF3NO2 MolecularWeight: 396.15807

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H9BrF3NO2/c18-10-4-1-3-9(7-10)14-8-12(16(23)24)11-5-2-6-13(15(11)22-14)17(19,20)21/h1-8H,(H,23,24)