hexyl 8-chloranyl-2-(4-methylphenyl)quinoline-4-carboxylate

Systemtic Name: hexyl 8-chloranyl-2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: hexyl 8-chloro-2-(p-tolyl)quinoline-4-carboxylate CAS Name: 8-chloro-2-(4-methylphenyl)-4-quinolinecarboxylic acid hexyl ester IUPAC Name: hexyl 8-chloro-2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 8-chloro-2-(p-tolyl)cinchoninic acid hexyl ester Formula: C23H24ClNO2 MolecularWeight: 381.89516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC(=NC2=C1C=CC=C2Cl)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCOC(=O)C1=CC(=NC2=C1C=CC=C2Cl)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H24ClNO2/c1-3-4-5-6-14-27-23(26)19-15-21(17-12-10-16(2)11-13-17)25-22-18(19)8-7-9-20(22)24/h7-13,15H,3-6,14H2,1-2H3