1,3-benzodioxol-5-yl-bis[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy]phosphoryl-methanone

Systemtic Name: 1,3-benzodioxol-5-yl-bis[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy]phosphoryl-methanone Openeye Name: 1,3-benzodioxol-5-yl-bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]phosphoryl-methanone CAS Name: 1,3-benzodioxol-5-yl-bis[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy]phosphorylmethanone IUPAC Name: 1,3-benzodioxol-5-yl-bis[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy]phosphorylmethanone Traditional Name: 1,3-benzodioxol-5-yl-bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]phosphoryl-methanone Formula: C28H43O6P MolecularWeight: 506.611181

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OP(=O)(C(=O)C2=CC3=C(C=C2)OCO3)OC4CC(CCC4C(C)C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OP(=O)(C(=O)C2=CC3=C(C=C2)OCO3)O[C@@H]4C[C@@H](CC[C@H]4C(C)C)C)C(C)C

InChI

InChI=1S/C28H43O6P/c1-17(2)22-10-7-19(5)13-25(22)33-35(30,34-26-14-20(6)8-11-23(26)18(3)4)28(29)21-9-12-24-27(15-21)32-16-31-24/h9,12,15,17-20,22-23,25-26H,7-8,10-11,13-14,16H2,1-6H3/t19-,20-,22+,23+,25-,26-/m1/s1