[(E)-5,5-dimethylhex-1-en-3-ynyl]sulfonylbenzene

Systemtic Name: [(E)-5,5-dimethylhex-1-en-3-ynyl]sulfonylbenzene Openeye Name: [(E)-5,5-dimethylhex-1-en-3-ynyl]sulfonylbenzene CAS Name: [(E)-5,5-dimethylhex-1-en-3-ynyl]sulfonylbenzene IUPAC Name: [(E)-5,5-dimethylhex-1-en-3-ynyl]sulfonylbenzene Traditional Name: [(E)-5,5-dimethylhex-1-en-3-ynyl]sulfonylbenzene Formula: C14H16O2S MolecularWeight: 248.34064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC=CS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C#C/C=C/S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H16O2S/c1-14(2,3)11-7-8-12-17(15,16)13-9-5-4-6-10-13/h4-6,8-10,12H,1-3H3/b12-8+