2-oxidanylpropane-1,2,3-tricarboxylate; N-(2,2,6,6-tetramethyl-1-oxidanyl-piperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-oxidanylpropane-1,2,3-tricarboxylate; N-(2,2,6,6-tetramethyl-1-oxidanyl-piperidin-1-ium-4-yl)ethanamide Openeye Name: N-(1-hydroxy-2,2,6,6-tetramethyl-piperidin-1-ium-4-yl)acetamide citrate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylate; N-(1-hydroxy-2,2,6,6-tetramethyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-hydroxypropane-1,2,3-tricarboxylate; N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide Traditional Name: N-(1-hydroxy-2,2,6,6-tetramethyl-piperidin-1-ium-4-yl)acetamide citrate Formula: C39H74N6O13 MolecularWeight: 835.03726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CC([NH+](C(C1)(C)C)O)(C)C.CC(=O)NC1CC([NH+](C(C1)(C)C)O)(C)C.CC(=O)NC1CC([NH+](C(C1)(C)C)O)(C)C.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CC(=O)NC1CC([NH+](C(C1)(C)C)O)(C)C.CC(=O)NC1CC([NH+](C(C1)(C)C)O)(C)C.CC(=O)NC1CC([NH+](C(C1)(C)C)O)(C)C.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/3C11H22N2O2.C6H8O7/c3*1-8(14)12-9-6-10(2,3)13(15)11(4,5)7-9;7-3(8)1-6(13,5(11)12)2-4(9)10/h3*9,15H,6-7H2,1-5H3,(H,12,14);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)