phenethyl 4-methyl-5-oxidanylidene-2-(trifluoromethyl)pentanoate

Systemtic Name: phenethyl 4-methyl-5-oxidanylidene-2-(trifluoromethyl)pentanoate Openeye Name: phenethyl 4-methyl-5-oxo-2-(trifluoromethyl)pentanoate CAS Name: 4-methyl-5-oxo-2-(trifluoromethyl)pentanoic acid phenethyl ester IUPAC Name: phenethyl 4-methyl-5-oxo-2-(trifluoromethyl)pentanoate Traditional Name: 5-keto-4-methyl-2-(trifluoromethyl)valeric acid phenethyl ester Formula: C15H17F3O3 MolecularWeight: 302.28889

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(=O)OCCC1=CC=CC=C1)C(F)(F)F)C=O

Isomeric SMILES

CC(CC(C(=O)OCCC1=CC=CC=C1)C(F)(F)F)C=O

InChI

InChI=1S/C15H17F3O3/c1-11(10-19)9-13(15(16,17)18)14(20)21-8-7-12-5-3-2-4-6-12/h2-6,10-11,13H,7-9H2,1H3