N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]-1-(2-nitrophenyl)isonipecotamide Formula: C26H34N4O4 MolecularWeight: 466.57256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])N4CCCCC4

InChI

InChI=1S/C26H34N4O4/c1-34-22-11-9-20(10-12-22)25(28-15-5-2-6-16-28)19-27-26(31)21-13-17-29(18-14-21)23-7-3-4-8-24(23)30(32)33/h3-4,7-12,21,25H,2,5-6,13-19H2,1H3,(H,27,31)