N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-(4-nitrophenyl)carbonylpiperidin-4-yl]piperidine-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-(4-nitrophenyl)carbonylpiperidin-4-yl]piperidine-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-(4-nitrobenzoyl)-4-piperidyl]piperidine-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-[(4-nitrophenyl)-oxomethyl]-4-piperidinyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-(4-nitrobenzoyl)piperidin-4-yl]piperidine-4-carboxamide Traditional Name: N-homoveratryl-1-[1-(4-nitrobenzoyl)-4-piperidyl]isonipecotamide Formula: C28H36N4O6 MolecularWeight: 524.60864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2CCN(CC2)C3CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2CCN(CC2)C3CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C28H36N4O6/c1-37-25-8-3-20(19-26(25)38-2)9-14-29-27(33)21-10-15-30(16-11-21)23-12-17-31(18-13-23)28(34)22-4-6-24(7-5-22)32(35)36/h3-8,19,21,23H,9-18H2,1-2H3,(H,29,33)