N-[2-(methylamino)-2-oxidanylidene-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-[2-(methylamino)-2-oxidanylidene-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-[2-(methylamino)-2-oxo-ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-[2-(methylamino)-2-oxoethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(methylamino)-2-oxoethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-[2-keto-2-(methylamino)ethyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C16H19F3N4O4 MolecularWeight: 388.34167

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CNC(=O)CNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H19F3N4O4/c1-20-14(24)9-21-15(25)10-4-6-22(7-5-10)12-3-2-11(16(17,18)19)8-13(12)23(26)27/h2-3,8,10H,4-7,9H2,1H3,(H,20,24)(H,21,25)