[2-(2-oxidanylidene-3-phenyl-cyclohexyl)-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-(2-oxidanylidene-3-phenyl-cyclohexyl)-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(2-oxo-3-phenyl-cyclohexyl)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(2-oxo-3-phenylcyclohexyl)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(2-oxo-3-phenylcyclohexyl)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(2-keto-3-phenyl-cyclohexyl)-1-phosphono-ethyl]phosphonic acid Formula: C14H20O7P2 MolecularWeight: 362.251922

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)C(C1)C2=CC=CC=C2)CC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1CC(C(=O)C(C1)C2=CC=CC=C2)CC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C14H20O7P2/c15-14-11(9-13(22(16,17)18)23(19,20)21)7-4-8-12(14)10-5-2-1-3-6-10/h1-3,5-6,11-13H,4,7-9H2,(H2,16,17,18)(H2,19,20,21)