[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-di(propan-2-yloxy)phosphorylbenzenesulfinate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-di(propan-2-yloxy)phosphorylbenzenesulfinate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-diisopropoxyphosphorylbenzenesulfinate CAS Name: 2-di(propan-2-yloxy)phosphorylbenzenesulfinic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-di(propan-2-yloxy)phosphorylbenzenesulfinate Traditional Name: 2-diisopropoxyphosphorylbenzenesulfinic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C22H37O5PS MolecularWeight: 444.564941

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OS(=O)C2=CC=CC=C2P(=O)(OC(C)C)OC(C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OS(=O)C2=CC=CC=C2P(=O)(OC(C)C)OC(C)C)C(C)C

InChI

InChI=1S/C22H37O5PS/c1-15(2)19-13-12-18(7)14-20(19)27-29(24)22-11-9-8-10-21(22)28(23,25-16(3)4)26-17(5)6/h8-11,15-20H,12-14H2,1-7H3/t18-,19+,20-,29?/m1/s1