5-methylidene-4-(4-methylphenyl)sulfonyl-2,3,3a,4,6,6a-hexahydropentalen-1-one

Systemtic Name: 5-methylidene-4-(4-methylphenyl)sulfonyl-2,3,3a,4,6,6a-hexahydropentalen-1-one Openeye Name: 5-methylene-4-(p-tolylsulfonyl)-2,3,3a,4,6,6a-hexahydropentalen-1-one CAS Name: 5-methylene-4-(4-methylphenyl)sulfonyl-2,3,3a,4,6,6a-hexahydropentalen-1-one IUPAC Name: 5-methylidene-4-(4-methylphenyl)sulfonyl-2,3,3a,4,6,6a-hexahydropentalen-1-one Traditional Name: 5-methylene-4-tosyl-2,3,3a,4,6,6a-hexahydropentalen-1-one Formula: C16H18O3S MolecularWeight: 290.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2C3CCC(=O)C3CC2=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2C3CCC(=O)C3CC2=C

InChI

InChI=1S/C16H18O3S/c1-10-3-5-12(6-4-10)20(18,19)16-11(2)9-14-13(16)7-8-15(14)17/h3-6,13-14,16H,2,7-9H2,1H3