6-(4-methylsulfonylphenyl)-7-phenylsulfanyl-9-oxaspiro[4.4]non-6-en-8-one

Systemtic Name: 6-(4-methylsulfonylphenyl)-7-phenylsulfanyl-9-oxaspiro[4.4]non-6-en-8-one Openeye Name: 6-(4-methylsulfonylphenyl)-7-phenylsulfanyl-9-oxaspiro[4.4]non-6-en-8-one CAS Name: 6-(4-methylsulfonylphenyl)-7-(phenylthio)-9-oxaspiro[4.4]non-6-en-8-one IUPAC Name: 6-(4-methylsulfonylphenyl)-7-phenylsulfanyl-9-oxaspiro[4.4]non-6-en-8-one Traditional Name: 6-(4-mesylphenyl)-7-(phenylthio)-9-oxaspiro[4.4]non-6-en-8-one Formula: C21H20O4S2 MolecularWeight: 400.5111

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)OC23CCCC3)SC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)OC23CCCC3)SC4=CC=CC=C4

InChI

InChI=1S/C21H20O4S2/c1-27(23,24)17-11-9-15(10-12-17)18-19(26-16-7-3-2-4-8-16)20(22)25-21(18)13-5-6-14-21/h2-4,7-12H,5-6,13-14H2,1H3