dimethyl 2-[2-chloranyl-6-fluoranyl-4-(trifluoromethyl)phenyl]propanedioate

Systemtic Name: dimethyl 2-[2-chloranyl-6-fluoranyl-4-(trifluoromethyl)phenyl]propanedioate Openeye Name: dimethyl 2-[2-chloro-6-fluoro-4-(trifluoromethyl)phenyl]propanedioate CAS Name: 2-[2-chloro-6-fluoro-4-(trifluoromethyl)phenyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2-chloro-6-fluoro-4-(trifluoromethyl)phenyl]propanedioate Traditional Name: 2-[2-chloro-6-fluoro-4-(trifluoromethyl)phenyl]malonic acid dimethyl ester Formula: C12H9ClF4O4 MolecularWeight: 328.644073

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=C(C=C(C=C1Cl)C(F)(F)F)F)C(=O)OC

Isomeric SMILES

COC(=O)C(C1=C(C=C(C=C1Cl)C(F)(F)F)F)C(=O)OC

InChI

InChI=1S/C12H9ClF4O4/c1-20-10(18)9(11(19)21-2)8-6(13)3-5(4-7(8)14)12(15,16)17/h3-4,9H,1-2H3