[2-(4-oxidanyl-2-propyl-phenoxy)-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(4-oxidanyl-2-propyl-phenoxy)-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(4-hydroxy-2-propyl-phenoxy)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(4-hydroxy-2-propylphenoxy)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(4-hydroxy-2-propylphenoxy)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(4-hydroxy-2-propyl-phenoxy)-1-phosphono-ethyl]phosphonic acid Formula: C11H18O8P2 MolecularWeight: 340.203342

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)O)OCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)O)OCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C11H18O8P2/c1-2-3-8-6-9(12)4-5-10(8)19-7-11(20(13,14)15)21(16,17)18/h4-6,11-12H,2-3,7H2,1H3,(H2,13,14,15)(H2,16,17,18)