5-[1,1-bis(oxidanylidene)thian-4-yl]-2-(2,6-diethyl-4-methyl-phenyl)-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 5-[1,1-bis(oxidanylidene)thian-4-yl]-2-(2,6-diethyl-4-methyl-phenyl)-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-(2,6-diethyl-4-methyl-phenyl)-5-(1,1-dioxothian-4-yl)-3-hydroxy-cyclohex-2-en-1-one CAS Name: 2-(2,6-diethyl-4-methylphenyl)-5-(1,1-dioxo-4-thianyl)-3-hydroxy-1-cyclohex-2-enone IUPAC Name: 2-(2,6-diethyl-4-methylphenyl)-5-(1,1-dioxothian-4-yl)-3-hydroxycyclohex-2-en-1-one Traditional Name: 2-(2,6-diethyl-4-methyl-phenyl)-5-(1,1-diketothian-4-yl)-3-hydroxy-cyclohex-2-en-1-one Formula: C22H30O4S MolecularWeight: 390.5362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1C2=C(CC(CC2=O)C3CCS(=O)(=O)CC3)O)CC)C

Isomeric SMILES

CCC1=CC(=CC(=C1C2=C(CC(CC2=O)C3CCS(=O)(=O)CC3)O)CC)C

InChI

InChI=1S/C22H30O4S/c1-4-15-10-14(3)11-16(5-2)21(15)22-19(23)12-18(13-20(22)24)17-6-8-27(25,26)9-7-17/h10-11,17-18,23H,4-9,12-13H2,1-3H3