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

Systemtic Name: 1-bromanyl-4-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]sulfonyl-benzene Openeye Name: 1-bromo-4-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]sulfonyl-benzene CAS Name: 1-bromo-4-[(2E,4E)-3-methyl-5-(2,6,6-trimethyl-1-cyclohexenyl)penta-2,4-dienyl]sulfonylbenzene IUPAC Name: 1-bromo-4-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]sulfonylbenzene Traditional Name: 1-bromo-4-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]sulfonyl-benzene Formula: C21H27BrO2S MolecularWeight: 423.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC(=CCS(=O)(=O)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C(=C/CS(=O)(=O)C2=CC=C(C=C2)Br)/C

InChI

InChI=1S/C21H27BrO2S/c1-16(7-12-20-17(2)6-5-14-21(20,3)4)13-15-25(23,24)19-10-8-18(22)9-11-19/h7-13H,5-6,14-15H2,1-4H3/b12-7+,16-13+