3-[2,3-bis(oxidanyl)-4-oxidanylidene-4-propanoyloxy-butanoyl]oxy-4-(trimethylazaniumyl)butanoate

Systemtic Name: 3-[2,3-bis(oxidanyl)-4-oxidanylidene-4-propanoyloxy-butanoyl]oxy-4-(trimethylazaniumyl)butanoate Openeye Name: 3-(2,3-dihydroxy-4-oxo-4-propanoyloxy-butanoyl)oxy-4-(trimethylammonio)butanoate CAS Name: 3-[2,3-dihydroxy-1,4-dioxo-4-(1-oxopropoxy)butoxy]-4-(trimethylammonio)butanoate IUPAC Name: 3-(2,3-dihydroxy-4-oxo-4-propanoyloxybutanoyl)oxy-4-(trimethylazaniumyl)butanoate Traditional Name: 3-(2,3-dihydroxy-4-keto-4-propionyloxy-butanoyl)oxy-4-(trimethylammonio)butyrate Formula: C14H23NO9 MolecularWeight: 349.33372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO9/c1-5-10(18)24-14(22)12(20)11(19)13(21)23-8(6-9(16)17)7-15(2,3)4/h8,11-12,19-20H,5-7H2,1-4H3