3-oxidanylidene-2-[1-(2-oxidanylpropanoyloxy)-2-(trimethylazaniumyl)ethyl]pentanoate

Systemtic Name: 3-oxidanylidene-2-[1-(2-oxidanylpropanoyloxy)-2-(trimethylazaniumyl)ethyl]pentanoate Openeye Name: 2-[1-(2-hydroxypropanoyloxy)-2-(trimethylammonio)ethyl]-3-oxo-pentanoate CAS Name: 2-[1-(2-hydroxy-1-oxopropoxy)-2-(trimethylammonio)ethyl]-3-oxopentanoate IUPAC Name: 2-[1-(2-hydroxypropanoyloxy)-2-(trimethylazaniumyl)ethyl]-3-oxopentanoate Traditional Name: 3-keto-2-[1-lactoyloxy-2-(trimethylammonio)ethyl]valerate Formula: C13H23NO6 MolecularWeight: 289.32482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C(C[N+](C)(C)C)OC(=O)C(C)O)C(=O)[O-]

Isomeric SMILES

CCC(=O)C(C(C[N+](C)(C)C)OC(=O)C(C)O)C(=O)[O-]

InChI

InChI=1S/C13H23NO6/c1-6-9(16)11(12(17)18)10(7-14(3,4)5)20-13(19)8(2)15/h8,10-11,15H,6-7H2,1-5H3