1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-4-carboxamide

Systemtic Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]piperidine-4-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[2-nitro-4-(trifluoromethyl)phenyl]-N-[1-(phenylmethyl)-3-pyrrolidinyl]-4-piperidinecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-1-[2-nitro-4-(trifluoromethyl)phenyl]isonipecotamide Formula: C24H27F3N4O3 MolecularWeight: 476.49139

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2CCN(C2)CC3=CC=CC=C3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2CCN(C2)CC3=CC=CC=C3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C24H27F3N4O3/c25-24(26,27)19-6-7-21(22(14-19)31(33)34)30-12-8-18(9-13-30)23(32)28-20-10-11-29(16-20)15-17-4-2-1-3-5-17/h1-7,14,18,20H,8-13,15-16H2,(H,28,32)