[3-(hexan-2-ylamino)-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-(hexan-2-ylamino)-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-(1-methylpentylamino)-1-phosphono-propyl]phosphonic acid CAS Name: [3-(hexan-2-ylamino)-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [3-(hexan-2-ylamino)-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-(1-methylpentylamino)-1-phosphono-propyl]phosphonic acid Formula: C9H23NO7P2 MolecularWeight: 319.228942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)NCCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCC(C)NCCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C9H23NO7P2/c1-3-4-5-8(2)10-7-6-9(11,18(12,13)14)19(15,16)17/h8,10-11H,3-7H2,1-2H3,(H2,12,13,14)(H2,15,16,17)