bis[4-[[[4-(aminomethyl)piperidin-1-yl]carbonylamino]methyl]piperazin-1-yl] cyclooctane-1,5-dicarboxylate

Systemtic Name: bis[4-[[[4-(aminomethyl)piperidin-1-yl]carbonylamino]methyl]piperazin-1-yl] cyclooctane-1,5-dicarboxylate Openeye Name: bis[4-[[[4-(aminomethyl)piperidine-1-carbonyl]amino]methyl]piperazin-1-yl] cyclooctane-1,5-dicarboxylate CAS Name: cyclooctane-1,5-dicarboxylic acid bis[4-[[[[4-(aminomethyl)-1-piperidinyl]-oxomethyl]amino]methyl]-1-piperazinyl] ester IUPAC Name: bis[4-[[[4-(aminomethyl)piperidine-1-carbonyl]amino]methyl]piperazin-1-yl] cyclooctane-1,5-dicarboxylate Traditional Name: cyclooctane-1,5-dicarboxylic acid bis[4-[[[4-(aminomethyl)piperidine-1-carbonyl]amino]methyl]piperazino] ester Formula: C34H62N10O6 MolecularWeight: 706.91948

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCCC(C1)C(=O)ON2CCN(CC2)CNC(=O)N3CCC(CC3)CN)C(=O)ON4CCN(CC4)CNC(=O)N5CCC(CC5)CN

Isomeric SMILES

C1CC(CCCC(C1)C(=O)ON2CCN(CC2)CNC(=O)N3CCC(CC3)CN)C(=O)ON4CCN(CC4)CNC(=O)N5CCC(CC5)CN

InChI

InChI=1S/C34H62N10O6/c35-23-27-7-11-41(12-8-27)33(47)37-25-39-15-19-43(20-16-39)49-31(45)29-3-1-4-30(6-2-5-29)32(46)50-44-21-17-40(18-22-44)26-38-34(48)42-13-9-28(24-36)10-14-42/h27-30H,1-26,35-36H2,(H,37,47)(H,38,48)