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

Systemtic Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(1S)-1-phenylethyl]piperidine-4-carboxamide Openeye Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(1S)-1-phenylethyl]piperidine-4-carboxamide CAS Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(1S)-1-phenylethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(1S)-1-phenylethyl]piperidine-4-carboxamide Traditional Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[(1S)-1-phenylethyl]isonipecotamide Formula: C21H22F3N3O3 MolecularWeight: 421.41289

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C21H22F3N3O3/c1-14(15-5-3-2-4-6-15)25-20(28)16-9-11-26(12-10-16)18-8-7-17(21(22,23)24)13-19(18)27(29)30/h2-8,13-14,16H,9-12H2,1H3,(H,25,28)/t14-/m0/s1