3-[[(2R)-3,3-dimethyl-2,4-bis(oxidanyl)butanoyl]amino]propanoate; 2-hydroxyethyl(trimethyl)azanium

Systemtic Name: 3-[[(2R)-3,3-dimethyl-2,4-bis(oxidanyl)butanoyl]amino]propanoate; 2-hydroxyethyl(trimethyl)azanium Openeye Name: 3-[[(2R)-2,4-dihydroxy-3,3-dimethyl-butanoyl]amino]propanoate; 2-hydroxyethyl(trimethyl)ammonium CAS Name: 3-[[(2R)-2,4-dihydroxy-3,3-dimethyl-1-oxobutyl]amino]propanoate; 2-hydroxyethyl(trimethyl)ammonium IUPAC Name: 3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoate; 2-hydroxyethyl(trimethyl)azanium Traditional Name: 3-[[(2R)-2,4-dihydroxy-3,3-dimethyl-butanoyl]amino]propionate; 2-hydroxyethyl(trimethyl)ammonium Formula: C14H30N2O6 MolecularWeight: 322.3978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(CO)[C@H](C(=O)NCCC(=O)[O-])O.C[N+](C)(C)CCO

InChI

InChI=1S/C9H17NO5.C5H14NO/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;1-6(2,3)4-5-7/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);7H,4-5H2,1-3H3/q;+1/p-1/t7-;/m0./s1