butyl 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate

Systemtic Name: butyl 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate Openeye Name: butyl 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-3,6,8-trimethyl-4-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 2-(4-chlorophenyl)-3,6,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-3,6,8-trimethyl-cinchoninic acid butyl ester Formula: C23H24ClNO2 MolecularWeight: 381.89516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C(=NC2=C(C=C(C=C12)C)C)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCCOC(=O)C1=C(C(=NC2=C(C=C(C=C12)C)C)C3=CC=C(C=C3)Cl)C

InChI

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