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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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