N-ethyl-N-[(3-fluorophenyl)methyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-ethyl-N-[(3-fluorophenyl)methyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-ethyl-N-[(3-fluorophenyl)methyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-ethyl-N-[(3-fluorophenyl)methyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-ethyl-N-[(3-fluorophenyl)methyl]-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-ethyl-N-(3-fluorobenzyl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C22H23F4N3O3 MolecularWeight: 453.429933

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)C(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H23F4N3O3/c1-2-27(14-15-4-3-5-18(23)12-15)21(30)16-8-10-28(11-9-16)19-7-6-17(22(24,25)26)13-20(19)29(31)32/h3-7,12-13,16H,2,8-11,14H2,1H3