cyclohexylsulfonyl 2-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-ethanoate

Systemtic Name: cyclohexylsulfonyl 2-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-ethanoate Openeye Name: cyclohexylsulfonyl 2-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-sulfanyl-acetate CAS Name: 2-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-2-mercaptoacetic acid cyclohexylsulfonyl ester IUPAC Name: cyclohexylsulfonyl 2-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2-sulfanylacetate Traditional Name: 2-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-2-mercapto-acetic acid cyclohexylsulfonyl ester Formula: C22H32O5S2 MolecularWeight: 440.61648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=O)OS(=O)(=O)C2CCCCC2)S)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=O)OS(=O)(=O)C2CCCCC2)S)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C22H32O5S2/c1-21(2,3)16-12-14(13-17(18(16)23)22(4,5)6)19(28)20(24)27-29(25,26)15-10-8-7-9-11-15/h12-13,15,28H,7-11H2,1-6H3