2-ethylhexyl 3-[2,6-bis(trifluoromethyl)phenyl]-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: 2-ethylhexyl 3-[2,6-bis(trifluoromethyl)phenyl]-3-oxidanylidene-2-phenyl-propanoate Openeye Name: 2-ethylhexyl 3-[2,6-bis(trifluoromethyl)phenyl]-3-oxo-2-phenyl-propanoate CAS Name: 3-[2,6-bis(trifluoromethyl)phenyl]-3-oxo-2-phenylpropanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 3-[2,6-bis(trifluoromethyl)phenyl]-3-oxo-2-phenylpropanoate Traditional Name: 3-[2,6-bis(trifluoromethyl)phenyl]-3-keto-2-phenyl-propionic acid 2-ethylhexyl ester Formula: C25H26F6O3 MolecularWeight: 488.462559

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCCC(CC)COC(=O)C(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C25H26F6O3/c1-3-5-10-16(4-2)15-34-23(33)20(17-11-7-6-8-12-17)22(32)21-18(24(26,27)28)13-9-14-19(21)25(29,30)31/h6-9,11-14,16,20H,3-5,10,15H2,1-2H3