methyl 4-[3,5-bis(trifluoromethyl)phenyl]benzoate

Systemtic Name: methyl 4-[3,5-bis(trifluoromethyl)phenyl]benzoate Openeye Name: methyl 4-[3,5-bis(trifluoromethyl)phenyl]benzoate CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3,5-bis(trifluoromethyl)phenyl]benzoate Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]benzoic acid methyl ester Formula: C16H10F6O2 MolecularWeight: 348.239819

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H10F6O2/c1-24-14(23)10-4-2-9(3-5-10)11-6-12(15(17,18)19)8-13(7-11)16(20,21)22/h2-8H,1H3