2,2-bis(2,2,6,6-tetraethyl-1-octoxy-piperidin-1-ium-1-yl)decanedioic acid

Systemtic Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxy-piperidin-1-ium-1-yl)decanedioic acid Openeye Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxy-piperidin-1-ium-1-yl)decanedioic acid CAS Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxy-1-piperidin-1-iumyl)decanedioic acid IUPAC Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxypiperidin-1-ium-1-yl)decanedioic acid Traditional Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxy-piperidin-1-ium-1-yl)sebacic acid Formula: C52H102N2O6+2 MolecularWeight: 851.37608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCO[N+]1(C(CCCC1(CC)CC)(CC)CC)C(CCCCCCCC(=O)O)(C(=O)O)[N+]2(C(CCCC2(CC)CC)(CC)CC)OCCCCCCCC

Isomeric SMILES

CCCCCCCCO[N+]1(C(CCCC1(CC)CC)(CC)CC)C(CCCCCCCC(=O)O)(C(=O)O)[N+]2(C(CCCC2(CC)CC)(CC)CC)OCCCCCCCC

InChI

InChI=1S/C52H100N2O6/c1-11-21-23-25-30-34-44-59-53(48(13-3,14-4)39-36-40-49(53,15-5)16-6)52(47(57)58,43-33-29-27-28-32-38-46(55)56)54(60-45-35-31-26-24-22-12-2)50(17-7,18-8)41-37-42-51(54,19-9)20-10/h11-45H2,1-10H3/p+2