[(2S)-2-acetyloxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium; (2S,3R)-2-azanyl-3-methyl-pentanoic acid; hydrochloride

Systemtic Name: [(2S)-2-acetyloxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium; (2S,3R)-2-azanyl-3-methyl-pentanoic acid; hydrochloride Openeye Name: [(2S)-2-acetoxy-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium; (2S,3R)-2-amino-3-methyl-pentanoic acid; hydrochloride CAS Name: [(2S)-2-acetyloxy-4-hydroxy-4-oxobutyl]-trimethylammonium; (2S,3R)-2-amino-3-methylpentanoic acid; hydrochloride IUPAC Name: [(2S)-2-acetyloxy-4-hydroxy-4-oxobutyl]-trimethylazanium; (2S,3R)-2-amino-3-methylpentanoic acid; hydrochloride Traditional Name: [(2S)-2-acetoxy-4-hydroxy-4-keto-butyl]-trimethyl-ammonium; (2S,3R)-2-amino-3-methyl-valeric acid; hydrochloride Formula: C15H32ClN2O6+ MolecularWeight: 371.87738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)O)N.CC(=O)O[C@@H](CC(=O)O)C[N+](C)(C)C.Cl

InChI

InChI=1S/C9H17NO4.C6H13NO2.ClH/c1-7(11)14-8(5-9(12)13)6-10(2,3)4;1-3-4(2)5(7)6(8)9;/h8H,5-6H2,1-4H3;4-5H,3,7H2,1-2H3,(H,8,9);1H/p+1/t8-;4-,5+;/m01./s1