5-bromanyl-2-(2-methylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 5-bromanyl-2-(2-methylphenyl)quinoline-4-carboxylic acid Openeye Name: 5-bromo-2-(o-tolyl)quinoline-4-carboxylic acid CAS Name: 5-bromo-2-(2-methylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 5-bromo-2-(2-methylphenyl)quinoline-4-carboxylic acid Traditional Name: 5-bromo-2-(o-tolyl)cinchoninic acid Formula: C17H12BrNO2 MolecularWeight: 342.18668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C(=CC=C3)Br)C(=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C(=CC=C3)Br)C(=C2)C(=O)O

InChI

InChI=1S/C17H12BrNO2/c1-10-5-2-3-6-11(10)15-9-12(17(20)21)16-13(18)7-4-8-14(16)19-15/h2-9H,1H3,(H,20,21)