iodanium (2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: iodanium (2S)-2-azanyl-4-oxidanyl-4-oxidanylidene-butanoate Openeye Name: iodonium (2S)-2-amino-4-hydroxy-4-oxo-butanoate CAS Name: iodonium (2S)-2-amino-4-hydroxy-4-oxobutanoate IUPAC Name: iodanium (2S)-2-amino-4-hydroxy-4-oxobutanoate Traditional Name: iodonium (2S)-2-amino-4-hydroxy-4-keto-butyrate Formula: C4H8INO4 MolecularWeight: 261.01509

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)[O-])N)C(=O)O.[IH2+]

Isomeric SMILES

C([C@@H](C(=O)[O-])N)C(=O)O.[IH2+]

InChI

InChI=1S/C4H7NO4.H2I/c5-2(4(8)9)1-3(6)7;/h2H,1,5H2,(H,6,7)(H,8,9);1H2/q;+1/p-1/t2-;/m0./s1