3-[[3-(2,2-dimethyloxan-4-yl)-6-methyl-heptanoyl]amino]propyl-diethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 3-[[3-(2,2-dimethyloxan-4-yl)-6-methyl-heptanoyl]amino]propyl-diethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 3-[[3-(2,2-dimethyltetrahydropyran-4-yl)-6-methyl-heptanoyl]amino]propyl-diethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 3-[[3-(2,2-dimethyl-4-oxanyl)-6-methyl-1-oxoheptyl]amino]propyl-diethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 3-[[3-(2,2-dimethyloxan-4-yl)-6-methylheptanoyl]amino]propyl-diethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 3-[[3-(2,2-dimethyltetrahydropyran-4-yl)-6-methyl-heptanoyl]amino]propyl-diethyl-ammonium binoxalate Formula: C24H46N2O6 MolecularWeight: 458.63184

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)CC(CCC(C)C)C1CCOC(C1)(C)C.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)CC(CCC(C)C)C1CCOC(C1)(C)C.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C22H44N2O2.C2H2O4/c1-7-24(8-2)14-9-13-23-21(25)16-19(11-10-18(3)4)20-12-15-26-22(5,6)17-20;3-1(4)2(5)6/h18-20H,7-17H2,1-6H3,(H,23,25);(H,3,4)(H,5,6)