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

Systemtic Name: ethyl 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate Openeye Name: ethyl 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-3,6,8-trimethyl-4-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-3,6,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-3,6,8-trimethyl-cinchoninic acid ethyl ester Formula: C21H20ClNO2 MolecularWeight: 353.842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClNO2/c1-5-25-21(24)18-14(4)20(15-6-8-16(22)9-7-15)23-19-13(3)10-12(2)11-17(18)19/h6-11H,5H2,1-4H3