[5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 4-(4-chloranyl-2-methyl-phenoxy)butanoate

Systemtic Name: [5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] 4-(4-chloranyl-2-methyl-phenoxy)butanoate Openeye Name: (5,7-dichloro-2-methyl-8-quinolyl) 4-(4-chloro-2-methyl-phenoxy)butanoate CAS Name: 4-(4-chloro-2-methylphenoxy)butanoic acid (5,7-dichloro-2-methyl-8-quinolinyl) ester IUPAC Name: (5,7-dichloro-2-methylquinolin-8-yl) 4-(4-chloro-2-methylphenoxy)butanoate Traditional Name: 4-(4-chloro-2-methyl-phenoxy)butyric acid (5,7-dichloro-2-methyl-8-quinolyl) ester Formula: C21H18Cl3NO3 MolecularWeight: 438.73152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2OC(=O)CCCOC3=C(C=C(C=C3)Cl)C)Cl)Cl

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2OC(=O)CCCOC3=C(C=C(C=C3)Cl)C)Cl)Cl

InChI

InChI=1S/C21H18Cl3NO3/c1-12-10-14(22)6-8-18(12)27-9-3-4-19(26)28-21-17(24)11-16(23)15-7-5-13(2)25-20(15)21/h5-8,10-11H,3-4,9H2,1-2H3