hexyl 8-chloranyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: hexyl 8-chloranyl-2-phenyl-quinoline-4-carboxylate Openeye Name: hexyl 8-chloro-2-phenyl-quinoline-4-carboxylate CAS Name: 8-chloro-2-phenyl-4-quinolinecarboxylic acid hexyl ester IUPAC Name: hexyl 8-chloro-2-phenylquinoline-4-carboxylate Traditional Name: 8-chloro-2-phenyl-cinchoninic acid hexyl ester Formula: C22H22ClNO2 MolecularWeight: 367.86858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClNO2/c1-2-3-4-8-14-26-22(25)18-15-20(16-10-6-5-7-11-16)24-21-17(18)12-9-13-19(21)23/h5-7,9-13,15H,2-4,8,14H2,1H3