butyl 2-(4-chlorophenyl)-6-methyl-quinoline-4-carboxylate

Systemtic Name: butyl 2-(4-chlorophenyl)-6-methyl-quinoline-4-carboxylate Openeye Name: butyl 2-(4-chlorophenyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-6-methyl-4-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 2-(4-chlorophenyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-6-methyl-cinchoninic acid butyl ester Formula: C21H20ClNO2 MolecularWeight: 353.842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClNO2/c1-3-4-11-25-21(24)18-13-20(15-6-8-16(22)9-7-15)23-19-10-5-14(2)12-17(18)19/h5-10,12-13H,3-4,11H2,1-2H3