tert-butyl 3-oxidanylidene-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 3-oxidanylidene-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 3-oxo-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxylate CAS Name: 3-oxo-4-[[4-(trifluoromethyl)phenyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxo-4-[[4-(trifluoromethyl)phenyl]methyl]piperazine-1-carboxylate Traditional Name: 3-keto-4-[4-(trifluoromethyl)benzyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H21F3N2O3 MolecularWeight: 358.35545

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(C(=O)C1)CC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(C(=O)C1)CC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H21F3N2O3/c1-16(2,3)25-15(24)22-9-8-21(14(23)11-22)10-12-4-6-13(7-5-12)17(18,19)20/h4-7H,8-11H2,1-3H3