(2-nitrophenyl)methyl 4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidine-1-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 4-oxidanyl-4-[3-(trifluoromethyl)phenyl]piperidine-1-carboxylate Openeye Name: (2-nitrophenyl)methyl 4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidine-1-carboxylate CAS Name: 4-hydroxy-4-[3-(trifluoromethyl)phenyl]-1-piperidinecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidine-1-carboxylate Traditional Name: 4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidine-1-carboxylic acid (2-nitrobenzyl) ester Formula: C20H19F3N2O5 MolecularWeight: 424.37047

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC(=CC=C2)C(F)(F)F)O)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1(C2=CC(=CC=C2)C(F)(F)F)O)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H19F3N2O5/c21-20(22,23)16-6-3-5-15(12-16)19(27)8-10-24(11-9-19)18(26)30-13-14-4-1-2-7-17(14)25(28)29/h1-7,12,27H,8-11,13H2