N-(2-diethylaminoethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(2-diethylaminoethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(2-diethylaminoethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(2-diethylaminoethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(2-diethylaminoethyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C19H27F3N4O3 MolecularWeight: 416.43789

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCNC(=O)C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H27F3N4O3/c1-3-24(4-2)12-9-23-18(27)14-7-10-25(11-8-14)16-6-5-15(19(20,21)22)13-17(16)26(28)29/h5-6,13-14H,3-4,7-12H2,1-2H3,(H,23,27)