2-methylpropyl 2-(4-chlorophenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: 2-methylpropyl 2-(4-chlorophenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: isobutyl 2-(4-chlorophenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-6,8-dimethyl-4-quinolinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(4-chlorophenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-6,8-dimethyl-cinchoninic acid isobutyl ester Formula: C22H22ClNO2 MolecularWeight: 367.86858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)OCC(C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)OCC(C)C)C

InChI

InChI=1S/C22H22ClNO2/c1-13(2)12-26-22(25)19-11-20(16-5-7-17(23)8-6-16)24-21-15(4)9-14(3)10-18(19)21/h5-11,13H,12H2,1-4H3