N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[2-(dimethylaminomethyl)benzyl]-1-(2-nitrophenyl)isonipecotamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O3/c1-24(2)16-19-8-4-3-7-18(19)15-23-22(27)17-11-13-25(14-12-17)20-9-5-6-10-21(20)26(28)29/h3-10,17H,11-16H2,1-2H3,(H,23,27)