methyl 2-[3-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[3-oxidanylidene-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-2-yl]ethanoate Openeye Name: methyl 2-[3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-oxo-1-[[3-(trifluoromethyl)phenyl]methyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[3-(trifluoromethyl)benzyl]piperazin-2-yl]acetic acid methyl ester Formula: C15H17F3N2O3 MolecularWeight: 330.30229

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

COC(=O)CC1C(=O)NCCN1CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C15H17F3N2O3/c1-23-13(21)8-12-14(22)19-5-6-20(12)9-10-3-2-4-11(7-10)15(16,17)18/h2-4,7,12H,5-6,8-9H2,1H3,(H,19,22)