[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-dimethoxyphosphorylethanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-dimethoxyphosphorylethanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 2-dimethoxyphosphorylacetate CAS Name: 2-dimethoxyphosphorylacetic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-dimethoxyphosphorylacetate Traditional Name: 2-dimethoxyphosphorylacetic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C20H31O5P MolecularWeight: 382.430901

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CP(=O)(OC)OC)C(C)(C)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)CP(=O)(OC)OC)C(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C20H31O5P/c1-15-11-12-17(20(2,3)16-9-7-6-8-10-16)18(13-15)25-19(21)14-26(22,23-4)24-5/h6-10,15,17-18H,11-14H2,1-5H3/t15-,17-,18-/m1/s1