ethyl 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: ethyl 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 4-[[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 4-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carbonyl]piperidine-1-carboxylic acid ethyl ester Formula: C20H25F3N4O5 MolecularWeight: 458.43151

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H25F3N4O5/c1-2-32-19(29)26-7-5-14(6-8-26)18(28)25-11-9-24(10-12-25)16-4-3-15(20(21,22)23)13-17(16)27(30)31/h3-4,13-14H,2,5-12H2,1H3