butyl 8-chloranyl-2-(4-methoxyphenyl)quinoline-4-carboxylate

Systemtic Name: butyl 8-chloranyl-2-(4-methoxyphenyl)quinoline-4-carboxylate Openeye Name: butyl 8-chloro-2-(4-methoxyphenyl)quinoline-4-carboxylate CAS Name: 8-chloro-2-(4-methoxyphenyl)-4-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 8-chloro-2-(4-methoxyphenyl)quinoline-4-carboxylate Traditional Name: 8-chloro-2-(4-methoxyphenyl)cinchoninic acid butyl ester Formula: C21H20ClNO3 MolecularWeight: 369.8414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=NC2=C1C=CC=C2Cl)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCOC(=O)C1=CC(=NC2=C1C=CC=C2Cl)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H20ClNO3/c1-3-4-12-26-21(24)17-13-19(14-8-10-15(25-2)11-9-14)23-20-16(17)6-5-7-18(20)22/h5-11,13H,3-4,12H2,1-2H3