2-methyl-5-oxidanyl-3-oxidanylidene-2-[1-oxidanyl-2-(trimethylazaniumyl)ethyl]hexanoate

Systemtic Name: 2-methyl-5-oxidanyl-3-oxidanylidene-2-[1-oxidanyl-2-(trimethylazaniumyl)ethyl]hexanoate Openeye Name: 5-hydroxy-2-[1-hydroxy-2-(trimethylammonio)ethyl]-2-methyl-3-oxo-hexanoate CAS Name: 5-hydroxy-2-[1-hydroxy-2-(trimethylammonio)ethyl]-2-methyl-3-oxohexanoate IUPAC Name: 5-hydroxy-2-[1-hydroxy-2-(trimethylazaniumyl)ethyl]-2-methyl-3-oxohexanoate Traditional Name: 5-hydroxy-2-[1-hydroxy-2-(trimethylammonio)ethyl]-3-keto-2-methyl-hexanoate Formula: C12H23NO5 MolecularWeight: 261.31472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23NO5/c1-8(14)6-9(15)12(2,11(17)18)10(16)7-13(3,4)5/h8,10,14,16H,6-7H2,1-5H3