ethyl 1-[4-nitro-2-(trifluoromethyl)phenyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[4-nitro-2-(trifluoromethyl)phenyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[4-nitro-2-(trifluoromethyl)phenyl]piperidine-3-carboxylate CAS Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-nitro-2-(trifluoromethyl)phenyl]piperidine-3-carboxylate Traditional Name: 1-[4-nitro-2-(trifluoromethyl)phenyl]nipecotic acid ethyl ester Formula: C15H17F3N2O4 MolecularWeight: 346.30169

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H17F3N2O4/c1-2-24-14(21)10-4-3-7-19(9-10)13-6-5-11(20(22)23)8-12(13)15(16,17)18/h5-6,8,10H,2-4,7,9H2,1H3