(4-azaniumyl-1-oxidanyl-1-phosphono-butyl)-oxidanyl-phosphinate

Systemtic Name: (4-azaniumyl-1-oxidanyl-1-phosphono-butyl)-oxidanyl-phosphinate Openeye Name: (4-azaniumyl-1-hydroxy-1-phosphono-butyl)-hydroxy-phosphinate CAS Name: (4-ammonio-1-hydroxy-1-phosphonobutyl)-hydroxyphosphinate IUPAC Name: (4-azaniumyl-1-hydroxy-1-phosphonobutyl)-hydroxyphosphinate Traditional Name: (4-ammonio-1-hydroxy-1-phosphono-butyl)-hydroxy-phosphinate Formula: C4H13NO7P2 MolecularWeight: 249.096042

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(O)(P(=O)(O)O)P(=O)(O)[O-])C[NH3+]

Isomeric SMILES

C(CC(O)(P(=O)(O)O)P(=O)(O)[O-])C[NH3+]

InChI

InChI=1S/C4H13NO7P2/c5-3-1-2-4(6,13(7,8)9)14(10,11)12/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12)