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

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-diphenylphosphorylethanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 2-diphenylphosphorylacetate CAS Name: 2-diphenylphosphorylacetic 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-diphenylphosphorylacetate Traditional Name: 2-diphenylphosphorylacetic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C30H35O3P MolecularWeight: 474.570861

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CP(=O)(C2=CC=CC=C2)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)CP(=O)(C2=CC=CC=C2)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C30H35O3P/c1-23-19-20-27(30(2,3)24-13-7-4-8-14-24)28(21-23)33-29(31)22-34(32,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-18,23,27-28H,19-22H2,1-3H3/t23-,27-,28-/m1/s1