3-carboxy-3,6-bis(oxidanyl)-6-oxidanylidene-hexanoate; 2-hydroxyethyl(trimethyl)azanium; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 3-carboxy-3,6-bis(oxidanyl)-6-oxidanylidene-hexanoate; 2-hydroxyethyl(trimethyl)azanium; 2-(trimethylazaniumyl)ethanoate Openeye Name: 3-carboxy-3,6-dihydroxy-6-oxo-hexanoate; 2-hydroxyethyl(trimethyl)ammonium; 2-(trimethylammonio)acetate CAS Name: 3-carboxy-3,6-dihydroxy-6-oxohexanoate; 2-hydroxyethyl(trimethyl)ammonium; 2-(trimethylammonio)acetate IUPAC Name: 3-carboxy-3,6-dihydroxy-6-oxohexanoate; 2-hydroxyethyl(trimethyl)azanium; 2-(trimethylazaniumyl)acetate Traditional Name: 3-carboxy-3,6-dihydroxy-6-keto-hexanoate; 2-hydroxyethyl(trimethyl)ammonium; 2-(trimethylammonio)acetate Formula: C17H34N2O10 MolecularWeight: 426.45926

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.C[N+](C)(C)CC(=O)[O-].C(CC(CC(=O)[O-])(C(=O)O)O)C(=O)O

Isomeric SMILES

C[N+](C)(C)CCO.C[N+](C)(C)CC(=O)[O-].C(CC(CC(=O)[O-])(C(=O)O)O)C(=O)O

InChI

InChI=1S/C7H10O7.C5H11NO2.C5H14NO/c8-4(9)1-2-7(14,6(12)13)3-5(10)11;1-6(2,3)4-5(7)8;1-6(2,3)4-5-7/h14H,1-3H2,(H,8,9)(H,10,11)(H,12,13);4H2,1-3H3;7H,4-5H2,1-3H3/q;;+1/p-1