phenethyl 4-(dimethylamino)-5-oxidanylidene-2-(trifluoromethyl)hexanoate

Systemtic Name: phenethyl 4-(dimethylamino)-5-oxidanylidene-2-(trifluoromethyl)hexanoate Openeye Name: phenethyl 4-(dimethylamino)-5-oxo-2-(trifluoromethyl)hexanoate CAS Name: 4-(dimethylamino)-5-oxo-2-(trifluoromethyl)hexanoic acid phenethyl ester IUPAC Name: phenethyl 4-(dimethylamino)-5-oxo-2-(trifluoromethyl)hexanoate Traditional Name: 4-(dimethylamino)-5-keto-2-(trifluoromethyl)hexanoic acid phenethyl ester Formula: C17H22F3NO3 MolecularWeight: 345.35669

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22F3NO3/c1-12(22)15(21(2)3)11-14(17(18,19)20)16(23)24-10-9-13-7-5-4-6-8-13/h4-8,14-15H,9-11H2,1-3H3