bis[2-(pyridin-3-ylcarbonylamino)ethyl] decanedioate dihydrochloride

Systemtic Name: bis[2-(pyridin-3-ylcarbonylamino)ethyl] decanedioate dihydrochloride Openeye Name: bis[2-(pyridine-3-carbonylamino)ethyl] decanedioate dihydrochloride CAS Name: decanedioic acid bis[2-[[oxo(3-pyridinyl)methyl]amino]ethyl] ester dihydrochloride IUPAC Name: bis[2-(pyridine-3-carbonylamino)ethyl] decanedioate dihydrochloride Traditional Name: sebacic acid bis(2-nicotinamidoethyl) ester dihydrochloride Formula: C26H36Cl2N4O6 MolecularWeight: 571.49324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NCCOC(=O)CCCCCCCCC(=O)OCCNC(=O)C2=CN=CC=C2.Cl.Cl

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NCCOC(=O)CCCCCCCCC(=O)OCCNC(=O)C2=CN=CC=C2.Cl.Cl

InChI

InChI=1S/C26H34N4O6.2ClH/c31-23(35-17-15-29-25(33)21-9-7-13-27-19-21)11-5-3-1-2-4-6-12-24(32)36-18-16-30-26(34)22-10-8-14-28-20-22;;/h7-10,13-14,19-20H,1-6,11-12,15-18H2,(H,29,33)(H,30,34);2*1H