2-azanyl-5-[4-oxidanidyl-4-oxidanylidene-1-(trimethylazaniumyl)butan-2-yl]oxy-5-oxidanylidene-pentanoate hydrochloride

Systemtic Name: 2-azanyl-5-[4-oxidanidyl-4-oxidanylidene-1-(trimethylazaniumyl)butan-2-yl]oxy-5-oxidanylidene-pentanoate hydrochloride Openeye Name: 2-amino-5-[3-oxido-3-oxo-1-[(trimethylammonio)methyl]propoxy]-5-oxo-pentanoate hydrochloride CAS Name: 2-amino-5-[4-oxido-4-oxo-1-(trimethylammonio)butan-2-yl]oxy-5-oxopentanoate hydrochloride IUPAC Name: 2-amino-5-[4-oxido-4-oxo-1-(trimethylazaniumyl)butan-2-yl]oxy-5-oxopentanoate hydrochloride Traditional Name: 2-amino-5-keto-5-[3-keto-3-oxido-1-[(trimethylammonio)methyl]propoxy]valerate hydrochloride Formula: C12H22ClN2O6- MolecularWeight: 325.76588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22N2O6.ClH/c1-14(2,3)7-8(6-10(15)16)20-11(17)5-4-9(13)12(18)19;/h8-9H,4-7,13H2,1-3H3,(H-,15,16,18,19);1H/p-1