1-[(E)-5-bromanyl-3-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enyl]sulfonyl-4-methyl-benzene

Systemtic Name: 1-[(E)-5-bromanyl-3-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enyl]sulfonyl-4-methyl-benzene Openeye Name: 1-[(E)-5-bromo-3-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enyl]sulfonyl-4-methyl-benzene CAS Name: 1-[(E)-5-bromo-3-methyl-1-(2,6,6-trimethyl-1-cyclohexenyl)pent-3-enyl]sulfonyl-4-methylbenzene IUPAC Name: 1-[(E)-5-bromo-3-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enyl]sulfonyl-4-methylbenzene Traditional Name: 1-[(E)-5-bromo-3-methyl-1-(2,6,6-trimethylcyclohexen-1-yl)pent-3-enyl]sulfonyl-4-methyl-benzene Formula: C22H31BrO2S MolecularWeight: 439.44934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C(CC(=CCBr)C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)C(C/C(=C/CBr)/C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H31BrO2S/c1-16-8-10-19(11-9-16)26(24,25)20(15-17(2)12-14-23)21-18(3)7-6-13-22(21,4)5/h8-12,20H,6-7,13-15H2,1-5H3/b17-12+