6-butan-2-yl-2-(2-chlorophenyl)quinoline-4-carboxylic acid

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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