(3-azaniumyl-4-oxidanyl-4-oxidanylidene-butyl)-methyl-phosphinate

Systemtic Name: (3-azaniumyl-4-oxidanyl-4-oxidanylidene-butyl)-methyl-phosphinate Openeye Name: (3-azaniumyl-4-hydroxy-4-oxo-butyl)-methyl-phosphinate CAS Name: (3-ammonio-4-hydroxy-4-oxobutyl)-methylphosphinate IUPAC Name: (3-azaniumyl-4-hydroxy-4-oxobutyl)-methylphosphinate Traditional Name: (3-ammonio-4-hydroxy-4-keto-butyl)-methyl-phosphinate Formula: C5H12NO4P MolecularWeight: 181.126841

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Descriptors Computed from Structure

Canonical SMILES:

CP(=O)(CCC(C(=O)O)[NH3+])[O-]

Isomeric SMILES

CP(=O)(CCC(C(=O)O)[NH3+])[O-]

InChI

InChI=1S/C5H12NO4P/c1-11(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)