[2-(1-adamantyl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(1-adamantyl)-1-oxidanyl-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(1-adamantyl)-1-hydroxy-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(1-adamantyl)-1-hydroxy-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(1-adamantyl)-1-hydroxy-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(1-adamantyl)-1-hydroxy-1-phosphono-ethyl]phosphonic acid Formula: C12H22O7P2 MolecularWeight: 340.246402

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C12H22O7P2/c13-12(20(14,15)16,21(17,18)19)7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10,13H,1-7H2,(H2,14,15,16)(H2,17,18,19)