6-bromanyl-7-chloranyl-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-7-chloranyl-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylic acid Openeye Name: 6-bromo-7-chloro-8-methyl-2-(p-tolyl)quinoline-4-carboxylic acid CAS Name: 6-bromo-7-chloro-8-methyl-2-(4-methylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-7-chloro-8-methyl-2-(4-methylphenyl)quinoline-4-carboxylic acid Traditional Name: 6-bromo-7-chloro-8-methyl-2-(p-tolyl)cinchoninic acid Formula: C18H13BrClNO2 MolecularWeight: 390.65832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C(=C(C=C3C(=C2)C(=O)O)Br)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C(=C(C=C3C(=C2)C(=O)O)Br)Cl)C

InChI

InChI=1S/C18H13BrClNO2/c1-9-3-5-11(6-4-9)15-8-13(18(22)23)12-7-14(19)16(20)10(2)17(12)21-15/h3-8H,1-2H3,(H,22,23)