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

Systemtic Name: 2-[[3-(2,2-dimethyloxan-4-yl)-6-methyl-heptanoyl]amino]ethyl-dimethyl-azanium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-[[3-(2,2-dimethyltetrahydropyran-4-yl)-6-methyl-heptanoyl]amino]ethyl-dimethyl-ammonium; 2-hydroxy-2-oxo-acetate CAS Name: 2-[[3-(2,2-dimethyl-4-oxanyl)-6-methyl-1-oxoheptyl]amino]ethyl-dimethylammonium; 2-hydroxy-2-oxoacetate IUPAC Name: 2-[[3-(2,2-dimethyloxan-4-yl)-6-methylheptanoyl]amino]ethyl-dimethylazanium; 2-hydroxy-2-oxoacetate Traditional Name: 2-[[3-(2,2-dimethyltetrahydropyran-4-yl)-6-methyl-heptanoyl]amino]ethyl-dimethyl-ammonium binoxalate Formula: C21H40N2O6 MolecularWeight: 416.5521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H38N2O2.C2H2O4/c1-15(2)7-8-16(13-18(22)20-10-11-21(5)6)17-9-12-23-19(3,4)14-17;3-1(4)2(5)6/h15-17H,7-14H2,1-6H3,(H,20,22);(H,3,4)(H,5,6)