N-[3-[methyl-(phenylmethyl)amino]propyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[3-[methyl-(phenylmethyl)amino]propyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[3-[methyl-(phenylmethyl)amino]propyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-1-(2-nitrophenyl)isonipecotamide Formula: C23H30N4O3 MolecularWeight: 410.5093

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C23H30N4O3/c1-25(18-19-8-3-2-4-9-19)15-7-14-24-23(28)20-12-16-26(17-13-20)21-10-5-6-11-22(21)27(29)30/h2-6,8-11,20H,7,12-18H2,1H3,(H,24,28)