methyl 4-bromanyl-2,5-bis(trifluoromethyl)benzoate

Systemtic Name: methyl 4-bromanyl-2,5-bis(trifluoromethyl)benzoate Openeye Name: methyl 4-bromo-2,5-bis(trifluoromethyl)benzoate CAS Name: 4-bromo-2,5-bis(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 4-bromo-2,5-bis(trifluoromethyl)benzoate Traditional Name: 4-bromo-2,5-bis(trifluoromethyl)benzoic acid methyl ester Formula: C10H5BrF6O2 MolecularWeight: 351.039919

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1C(F)(F)F)Br)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1C(F)(F)F)Br)C(F)(F)F

InChI

InChI=1S/C10H5BrF6O2/c1-19-8(18)4-2-6(10(15,16)17)7(11)3-5(4)9(12,13)14/h2-3H,1H3