2,2-bis(1,5,6,6-tetramethyl-1-octoxy-piperidin-1-ium-2-yl)decanedioate

Systemtic Name: 2,2-bis(1,5,6,6-tetramethyl-1-octoxy-piperidin-1-ium-2-yl)decanedioate Openeye Name: 2,2-bis(1,5,6,6-tetramethyl-1-octoxy-piperidin-1-ium-2-yl)decanedioate CAS Name: 2,2-bis(1,5,6,6-tetramethyl-1-octoxy-2-piperidin-1-iumyl)decanedioate IUPAC Name: 2,2-bis(1,5,6,6-tetramethyl-1-octoxypiperidin-1-ium-2-yl)decanedioate Traditional Name: 2,2-bis(1,5,6,6-tetramethyl-1-octoxy-piperidin-1-ium-2-yl)sebacate Formula: C44H84N2O6 MolecularWeight: 737.14756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCO[N+]1(C(CCC(C1(C)C)C)C(CCCCCCCC(=O)[O-])(C2CCC(C([N+]2(C)OCCCCCCCC)(C)C)C)C(=O)[O-])C

Isomeric SMILES

CCCCCCCCO[N+]1(C(CCC(C1(C)C)C)C(CCCCCCCC(=O)[O-])(C2CCC(C([N+]2(C)OCCCCCCCC)(C)C)C)C(=O)[O-])C

InChI

InChI=1S/C44H84N2O6/c1-11-13-15-17-22-26-34-51-45(9)38(31-29-36(3)42(45,5)6)44(41(49)50,33-25-21-19-20-24-28-40(47)48)39-32-30-37(4)43(7,8)46(39,10)52-35-27-23-18-16-14-12-2/h36-39H,11-35H2,1-10H3