3-methyl-5-oxidanylidene-5-[4-oxidanyl-4-oxidanylidene-1-(trimethylazaniumyl)butan-2-yl]oxy-pentanoate

Systemtic Name: 3-methyl-5-oxidanylidene-5-[4-oxidanyl-4-oxidanylidene-1-(trimethylazaniumyl)butan-2-yl]oxy-pentanoate Openeye Name: 5-[3-hydroxy-3-oxo-1-[(trimethylammonio)methyl]propoxy]-3-methyl-5-oxo-pentanoate CAS Name: 5-[4-hydroxy-4-oxo-1-(trimethylammonio)butan-2-yl]oxy-3-methyl-5-oxopentanoate IUPAC Name: 5-[4-hydroxy-4-oxo-1-(trimethylazaniumyl)butan-2-yl]oxy-3-methyl-5-oxopentanoate Traditional Name: 5-[3-hydroxy-3-keto-1-[(trimethylammonio)methyl]propoxy]-5-keto-3-methyl-valerate Formula: C13H23NO6 MolecularWeight: 289.32482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23NO6/c1-9(5-11(15)16)6-13(19)20-10(7-12(17)18)8-14(2,3)4/h9-10H,5-8H2,1-4H3,(H-,15,16,17,18)