8-bromanyl-2-[2-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid

Systemtic Name: 8-bromanyl-2-[2-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid Openeye Name: 8-bromo-2-[2-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid CAS Name: 8-bromo-2-[2-(trifluoromethyl)phenyl]-4-quinolinecarboxylic acid IUPAC Name: 8-bromo-2-[2-(trifluoromethyl)phenyl]quinoline-4-carboxylic acid Traditional Name: 8-bromo-2-[2-(trifluoromethyl)phenyl]cinchoninic acid Formula: C17H9BrF3NO2 MolecularWeight: 396.15807

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(C=CC=C3Br)C(=C2)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(C=CC=C3Br)C(=C2)C(=O)O)C(F)(F)F

InChI

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