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

Systemtic Name: pentyl 2-(4-chlorophenyl)-6-methyl-quinoline-4-carboxylate Openeye Name: pentyl 2-(4-chlorophenyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-6-methyl-4-quinolinecarboxylic acid pentyl ester IUPAC Name: pentyl 2-(4-chlorophenyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-6-methyl-cinchoninic acid amyl ester Formula: C22H22ClNO2 MolecularWeight: 367.86858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClNO2/c1-3-4-5-12-26-22(25)19-14-21(16-7-9-17(23)10-8-16)24-20-11-6-15(2)13-18(19)20/h6-11,13-14H,3-5,12H2,1-2H3