(phenylmethyl) 3-[3,5-bis(trifluoromethyl)phenyl]-2-oxidanylidene-propanoate

Systemtic Name: (phenylmethyl) 3-[3,5-bis(trifluoromethyl)phenyl]-2-oxidanylidene-propanoate Openeye Name: benzyl 3-[3,5-bis(trifluoromethyl)phenyl]-2-oxo-propanoate CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-2-oxopropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[3,5-bis(trifluoromethyl)phenyl]-2-oxopropanoate Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]-2-keto-propionic acid benzyl ester Formula: C18H12F6O3 MolecularWeight: 390.276499

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=O)CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(=O)CC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H12F6O3/c19-17(20,21)13-6-12(7-14(9-13)18(22,23)24)8-15(25)16(26)27-10-11-4-2-1-3-5-11/h1-7,9H,8,10H2