[5-(diphenylphosphanyloxymethyl)-3,3-dimethyl-cyclohexyl] dihydrogen phosphate

Systemtic Name: [5-(diphenylphosphanyloxymethyl)-3,3-dimethyl-cyclohexyl] dihydrogen phosphate Openeye Name: [5-(diphenylphosphanyloxymethyl)-3,3-dimethyl-cyclohexyl] dihydrogen phosphate CAS Name: [5-(diphenylphosphinooxymethyl)-3,3-dimethylcyclohexyl] dihydrogen phosphate IUPAC Name: [5-(diphenylphosphanyloxymethyl)-3,3-dimethylcyclohexyl] dihydrogen phosphate Traditional Name: [5-(diphenylphosphinooxymethyl)-3,3-dimethyl-cyclohexyl] dihydrogen phosphate Formula: C21H28O5P2 MolecularWeight: 422.391542

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)OP(=O)(O)O)COP(C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(CC(C1)OP(=O)(O)O)COP(C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H28O5P2/c1-21(2)14-17(13-18(15-21)26-28(22,23)24)16-25-27(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,17-18H,13-16H2,1-2H3,(H2,22,23,24)