[2-[(2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl]oxy-3-carboxy-4-oxidanylidene-pentyl]-trimethyl-azanium

Systemtic Name: [2-[(2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl]oxy-3-carboxy-4-oxidanylidene-pentyl]-trimethyl-azanium Openeye Name: [2-[(2S)-2-amino-4-hydroxy-4-oxo-butanoyl]oxy-3-carboxy-4-oxo-pentyl]-trimethyl-ammonium CAS Name: [2-[(2S)-2-amino-4-hydroxy-1,4-dioxobutoxy]-3-carboxy-4-oxopentyl]-trimethylammonium IUPAC Name: [2-[(2S)-2-amino-4-hydroxy-4-oxobutanoyl]oxy-3-carboxy-4-oxopentyl]-trimethylazanium Traditional Name: [2-[(2S)-2-amino-4-hydroxy-4-keto-butanoyl]oxy-3-carboxy-4-keto-pentyl]-trimethyl-ammonium Formula: C13H23N2O7+ MolecularWeight: 319.33092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O7/c1-7(16)11(12(19)20)9(6-15(2,3)4)22-13(21)8(14)5-10(17)18/h8-9,11H,5-6,14H2,1-4H3,(H-,17,18,19,20)/p+1/t8-,9?,11?/m0/s1