(4R,5R)-5-methyl-4-[[(S)-(4-methylphenyl)sulfinyl]methyl]-4-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: (4R,5R)-5-methyl-4-[[(S)-(4-methylphenyl)sulfinyl]methyl]-4-oxidanyl-cyclohex-2-en-1-one Openeye Name: (4R,5R)-4-hydroxy-5-methyl-4-[[(S)-p-tolylsulfinyl]methyl]cyclohex-2-en-1-one CAS Name: (4R,5R)-4-hydroxy-5-methyl-4-[[(S)-(4-methylphenyl)sulfinyl]methyl]-1-cyclohex-2-enone IUPAC Name: (4R,5R)-4-hydroxy-5-methyl-4-[[(S)-(4-methylphenyl)sulfinyl]methyl]cyclohex-2-en-1-one Traditional Name: (4R,5R)-4-hydroxy-5-methyl-4-[[(S)-p-tolylsulfinyl]methyl]cyclohex-2-en-1-one Formula: C15H18O3S MolecularWeight: 278.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C=CC1(CS(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

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

InChI

InChI=1S/C15H18O3S/c1-11-3-5-14(6-4-11)19(18)10-15(17)8-7-13(16)9-12(15)2/h3-8,12,17H,9-10H2,1-2H3/t12-,15-,19+/m1/s1