6-butyl-2-(2-chlorophenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-butyl-2-(2-chlorophenyl)quinoline-4-carboxylic acid Openeye Name: 6-butyl-2-(2-chlorophenyl)quinoline-4-carboxylic acid CAS Name: 6-butyl-2-(2-chlorophenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-butyl-2-(2-chlorophenyl)quinoline-4-carboxylic acid Traditional Name: 6-butyl-2-(2-chlorophenyl)cinchoninic acid Formula: C20H18ClNO2 MolecularWeight: 339.81542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=CC=C3Cl

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H18ClNO2/c1-2-3-6-13-9-10-18-15(11-13)16(20(23)24)12-19(22-18)14-7-4-5-8-17(14)21/h4-5,7-12H,2-3,6H2,1H3,(H,23,24)