[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-chloranylbenzenesulfinate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-chloranylbenzenesulfinate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-chlorobenzenesulfinate CAS Name: 2-chlorobenzenesulfinic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-chlorobenzenesulfinate Traditional Name: 2-chlorobenzenesulfinic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C16H23ClO2S MolecularWeight: 314.87062

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OS(=O)C2=CC=CC=C2Cl)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)O[S@](=O)C2=CC=CC=C2Cl)C(C)C

InChI

InChI=1S/C16H23ClO2S/c1-11(2)13-9-8-12(3)10-15(13)19-20(18)16-7-5-4-6-14(16)17/h4-7,11-13,15H,8-10H2,1-3H3/t12-,13+,15-,20+/m1/s1