5-chloranyl-8-methyl-2-(2-methylphenyl)quinoline-4-carboxylic acid

Systemtic Name: 5-chloranyl-8-methyl-2-(2-methylphenyl)quinoline-4-carboxylic acid Openeye Name: 5-chloro-8-methyl-2-(o-tolyl)quinoline-4-carboxylic acid CAS Name: 5-chloro-8-methyl-2-(2-methylphenyl)-4-quinolinecarboxylic acid IUPAC Name: 5-chloro-8-methyl-2-(2-methylphenyl)quinoline-4-carboxylic acid Traditional Name: 5-chloro-8-methyl-2-(o-tolyl)cinchoninic acid Formula: C18H14ClNO2 MolecularWeight: 311.76226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)C(=CC(=N2)C3=CC=CC=C3C)C(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)C(=CC(=N2)C3=CC=CC=C3C)C(=O)O

InChI

InChI=1S/C18H14ClNO2/c1-10-5-3-4-6-12(10)15-9-13(18(21)22)16-14(19)8-7-11(2)17(16)20-15/h3-9H,1-2H3,(H,21,22)