(2-butyl-2-methoxy-1-oxidanyl-1-phosphono-hexyl)phosphonic acid

Systemtic Name: (2-butyl-2-methoxy-1-oxidanyl-1-phosphono-hexyl)phosphonic acid Openeye Name: (2-butyl-1-hydroxy-2-methoxy-1-phosphono-hexyl)phosphonic acid CAS Name: (2-butyl-1-hydroxy-2-methoxy-1-phosphonohexyl)phosphonic acid IUPAC Name: (2-butyl-1-hydroxy-2-methoxy-1-phosphonohexyl)phosphonic acid Traditional Name: (2-butyl-1-hydroxy-2-methoxy-1-phosphono-hexyl)phosphonic acid Formula: C11H26O8P2 MolecularWeight: 348.266862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(C(O)(P(=O)(O)O)P(=O)(O)O)OC

Isomeric SMILES

CCCCC(CCCC)(C(O)(P(=O)(O)O)P(=O)(O)O)OC

InChI

InChI=1S/C11H26O8P2/c1-4-6-8-10(19-3,9-7-5-2)11(12,20(13,14)15)21(16,17)18/h12H,4-9H2,1-3H3,(H2,13,14,15)(H2,16,17,18)