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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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