[3-(azepan-1-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-(azepan-1-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [3-(azepan-1-yl)-1-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [3-(1-azepanyl)-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [3-(azepan-1-yl)-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [3-(azepan-1-yl)-1-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C9H21NO7P2 MolecularWeight: 317.213062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1CCCN(CC1)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C9H21NO7P2/c11-9(18(12,13)14,19(15,16)17)5-8-10-6-3-1-2-4-7-10/h11H,1-8H2,(H2,12,13,14)(H2,15,16,17)