4-oxidanylidene-4-(1-oxidanyl-1-oxidanylidene-propan-2-yl)peroxy-butanoate; tris(2-hydroxyethyl)azanium

Systemtic Name: 4-oxidanylidene-4-(1-oxidanyl-1-oxidanylidene-propan-2-yl)peroxy-butanoate; tris(2-hydroxyethyl)azanium Openeye Name: 4-(2-hydroxy-1-methyl-2-oxo-ethyl)peroxy-4-oxo-butanoate; tris(2-hydroxyethyl)ammonium CAS Name: 4-(1-hydroxy-1-oxopropan-2-yl)dioxy-4-oxobutanoate; tris(2-hydroxyethyl)ammonium IUPAC Name: 4-(1-hydroxy-1-oxopropan-2-yl)peroxy-4-oxobutanoate; tris(2-hydroxyethyl)azanium Traditional Name: 4-(2-hydroxy-2-keto-1-methyl-ethyl)peroxy-4-keto-butyrate; tris(2-hydroxyethyl)ammonium Formula: C13H25NO10 MolecularWeight: 355.3383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OOC(=O)CCC(=O)[O-].C(CO)[NH+](CCO)CCO

Isomeric SMILES

CC(C(=O)O)OOC(=O)CCC(=O)[O-].C(CO)[NH+](CCO)CCO

InChI

InChI=1S/C7H10O7.C6H15NO3/c1-4(7(11)12)13-14-6(10)3-2-5(8)9;8-4-1-7(2-5-9)3-6-10/h4H,2-3H2,1H3,(H,8,9)(H,11,12);8-10H,1-6H2