[2,4-bis(oxidanyl)-4-oxidanylidene-butyl]-trimethyl-azanium; methanesulfonate

Systemtic Name: [2,4-bis(oxidanyl)-4-oxidanylidene-butyl]-trimethyl-azanium; methanesulfonate Openeye Name: (2,4-dihydroxy-4-oxo-butyl)-trimethyl-ammonium; methanesulfonate CAS Name: (2,4-dihydroxy-4-oxobutyl)-trimethylammonium; methanesulfonate IUPAC Name: (2,4-dihydroxy-4-oxobutyl)-trimethylazanium; methanesulfonate Traditional Name: (2,4-dihydroxy-4-keto-butyl)-trimethyl-ammonium mesylate Formula: C8H19NO6S MolecularWeight: 257.30456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H15NO3.CH4O3S/c1-8(2,3)5-6(9)4-7(10)11;1-5(2,3)4/h6,9H,4-5H2,1-3H3;1H3,(H,2,3,4)