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

Systemtic Name: ethyl 4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C14H16F3N3O4 MolecularWeight: 347.28975

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H16F3N3O4/c1-2-24-13(21)19-7-5-18(6-8-19)11-4-3-10(14(15,16)17)9-12(11)20(22)23/h3-4,9H,2,5-8H2,1H3