sodium (6-azanyl-1-oxidanyl-1-phosphono-hexyl)phosphonic acid

Systemtic Name: sodium (6-azanyl-1-oxidanyl-1-phosphono-hexyl)phosphonic acid Openeye Name: sodium (6-amino-1-hydroxy-1-phosphono-hexyl)phosphonic acid CAS Name: sodium (6-amino-1-hydroxy-1-phosphonohexyl)phosphonic acid IUPAC Name: sodium (6-amino-1-hydroxy-1-phosphonohexyl)phosphonic acid Traditional Name: sodium (6-amino-1-hydroxy-1-phosphono-hexyl)phosphonic acid Formula: C6H17NNaO7P2+ MolecularWeight: 300.138972

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(O)(P(=O)(O)O)P(=O)(O)O)CCN.[Na+]

Isomeric SMILES

C(CCC(O)(P(=O)(O)O)P(=O)(O)O)CCN.[Na+]

InChI

InChI=1S/C6H17NO7P2.Na/c7-5-3-1-2-4-6(8,15(9,10)11)16(12,13)14;/h8H,1-5,7H2,(H2,9,10,11)(H2,12,13,14);/q;+1