(2,4-dichlorophenyl)methyl 3-ethyl-2-propyl-quinoline-4-carboxylate

Systemtic Name: (2,4-dichlorophenyl)methyl 3-ethyl-2-propyl-quinoline-4-carboxylate Openeye Name: (2,4-dichlorophenyl)methyl 3-ethyl-2-propyl-quinoline-4-carboxylate CAS Name: 3-ethyl-2-propyl-4-quinolinecarboxylic acid (2,4-dichlorophenyl)methyl ester IUPAC Name: (2,4-dichlorophenyl)methyl 3-ethyl-2-propylquinoline-4-carboxylate Traditional Name: 3-ethyl-2-propyl-cinchoninic acid (2,4-dichlorobenzyl) ester Formula: C22H21Cl2NO2 MolecularWeight: 402.31364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=C1CC)C(=O)OCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H21Cl2NO2/c1-3-7-19-16(4-2)21(17-8-5-6-9-20(17)25-19)22(26)27-13-14-10-11-15(23)12-18(14)24/h5-6,8-12H,3-4,7,13H2,1-2H3