[(2R)-2-acetyloxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium; (2S)-2-azanylbutanedioic acid

Systemtic Name: [(2R)-2-acetyloxy-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium; (2S)-2-azanylbutanedioic acid Openeye Name: [(2R)-2-acetoxy-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium; (2S)-2-aminobutanedioic acid CAS Name: [(2R)-2-acetyloxy-4-hydroxy-4-oxobutyl]-trimethylammonium; (2S)-2-aminobutanedioic acid IUPAC Name: [(2R)-2-acetyloxy-4-hydroxy-4-oxobutyl]-trimethylazanium; (2S)-2-aminobutanedioic acid Traditional Name: [(2R)-2-acetoxy-4-hydroxy-4-keto-butyl]-trimethyl-ammonium; (2S)-2-aminosuccinic acid Formula: C13H25N2O8+ MolecularWeight: 337.3462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17NO4.C4H7NO4/c1-7(11)14-8(5-9(12)13)6-10(2,3)4;5-2(4(8)9)1-3(6)7/h8H,5-6H2,1-4H3;2H,1,5H2,(H,6,7)(H,8,9)/p+1/t8-;2-/m10/s1