methyl 4-[4-[3-[1-(4-methoxycarbonyl-2-nitro-phenyl)piperidin-4-yl]propyl]piperidin-1-yl]-3-nitro-benzoate

Systemtic Name: methyl 4-[4-[3-[1-(4-methoxycarbonyl-2-nitro-phenyl)piperidin-4-yl]propyl]piperidin-1-yl]-3-nitro-benzoate Openeye Name: methyl 4-[4-[3-[1-(4-methoxycarbonyl-2-nitro-phenyl)-4-piperidyl]propyl]-1-piperidyl]-3-nitro-benzoate CAS Name: 4-[4-[3-[1-(4-methoxycarbonyl-2-nitrophenyl)-4-piperidinyl]propyl]-1-piperidinyl]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[4-[3-[1-(4-methoxycarbonyl-2-nitrophenyl)piperidin-4-yl]propyl]piperidin-1-yl]-3-nitrobenzoate Traditional Name: 4-[4-[3-[1-(4-carbomethoxy-2-nitro-phenyl)-4-piperidyl]propyl]piperidino]-3-nitro-benzoic acid methyl ester Formula: C29H36N4O8 MolecularWeight: 568.61814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCC(CC2)CCCC3CCN(CC3)C4=C(C=C(C=C4)C(=O)OC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCC(CC2)CCCC3CCN(CC3)C4=C(C=C(C=C4)C(=O)OC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C29H36N4O8/c1-40-28(34)22-6-8-24(26(18-22)32(36)37)30-14-10-20(11-15-30)4-3-5-21-12-16-31(17-13-21)25-9-7-23(29(35)41-2)19-27(25)33(38)39/h6-9,18-21H,3-5,10-17H2,1-2H3