4,8a-dimethyl-4-(methylperoxymethyl)-8-[(E)-2-phenylsulfanylethenyl]-1,2,3,4a,5,6-hexahydronaphthalene

Systemtic Name: 4,8a-dimethyl-4-(methylperoxymethyl)-8-[(E)-2-phenylsulfanylethenyl]-1,2,3,4a,5,6-hexahydronaphthalene Openeye Name: 4,8a-dimethyl-4-(methylperoxymethyl)-8-[(E)-2-phenylsulfanylvinyl]-1,2,3,4a,5,6-hexahydronaphthalene CAS Name: 4,8a-dimethyl-4-(methyldioxymethyl)-8-[(E)-2-(phenylthio)ethenyl]-1,2,3,4a,5,6-hexahydronaphthalene IUPAC Name: 4,8a-dimethyl-4-(methylperoxymethyl)-8-[(E)-2-phenylsulfanylethenyl]-1,2,3,4a,5,6-hexahydronaphthalene Traditional Name: 4,8a-dimethyl-4-(methylperoxymethyl)-8-[(E)-2-(phenylthio)vinyl]-1,2,3,4a,5,6-hexahydronaphthalene Formula: C22H30O2S MolecularWeight: 358.5374

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2(C1CCC=C2C=CSC3=CC=CC=C3)C)COOC

Isomeric SMILES

CC1(CCCC2(C1CCC=C2/C=C/SC3=CC=CC=C3)C)COOC

InChI

InChI=1S/C22H30O2S/c1-21(17-24-23-3)14-8-15-22(2)18(9-7-12-20(21)22)13-16-25-19-10-5-4-6-11-19/h4-6,9-11,13,16,20H,7-8,12,14-15,17H2,1-3H3/b16-13+