tert-butyl 4-[2-methanoyl-3-(trifluoromethyl)phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-methanoyl-3-(trifluoromethyl)phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-formyl-3-(trifluoromethyl)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-formyl-3-(trifluoromethyl)phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-formyl-3-(trifluoromethyl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-formyl-3-(trifluoromethyl)phenyl]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(CC1)C2=CC=CC(=C2C=O)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=CC(=C2C=O)C(F)(F)F

InChI

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