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

Systemtic Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxy-piperidin-1-ium-1-yl)decanedioate Openeye Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxy-piperidin-1-ium-1-yl)decanedioate CAS Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxy-1-piperidin-1-iumyl)decanedioate IUPAC Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxypiperidin-1-ium-1-yl)decanedioate Traditional Name: 2,2-bis(2,2,6,6-tetraethyl-1-octoxy-piperidin-1-ium-1-yl)sebacate Formula: C52H100N2O6 MolecularWeight: 849.3602

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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