ethyl (2R)-5-ethoxy-2-[(1S,2S)-2-(4-methylphenyl)sulfinyl-1-oxidanyl-cyclohexyl]pentanoate

Systemtic Name: ethyl (2R)-5-ethoxy-2-[(1S,2S)-2-(4-methylphenyl)sulfinyl-1-oxidanyl-cyclohexyl]pentanoate Openeye Name: ethyl (2R)-5-ethoxy-2-[(1S,2S)-1-hydroxy-2-(p-tolylsulfinyl)cyclohexyl]pentanoate CAS Name: (2R)-5-ethoxy-2-[(1S,2S)-1-hydroxy-2-(4-methylphenyl)sulfinylcyclohexyl]pentanoic acid ethyl ester IUPAC Name: ethyl (2R)-5-ethoxy-2-[(1S,2S)-1-hydroxy-2-(4-methylphenyl)sulfinylcyclohexyl]pentanoate Traditional Name: (2R)-5-ethoxy-2-[(1S,2S)-1-hydroxy-2-(p-tolylsulfinyl)cyclohexyl]valeric acid ethyl ester Formula: C22H34O5S MolecularWeight: 410.56736

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCC(C(=O)OCC)C1(CCCCC1S(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

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

InChI

InChI=1S/C22H34O5S/c1-4-26-16-8-9-19(21(23)27-5-2)22(24)15-7-6-10-20(22)28(25)18-13-11-17(3)12-14-18/h11-14,19-20,24H,4-10,15-16H2,1-3H3/t19-,20-,22-,28?/m0/s1