[(E)-6-methoxy-3-(trifluoromethyl)hex-2-en-4-yn-2-yl]sulfonylbenzene

Systemtic Name: [(E)-6-methoxy-3-(trifluoromethyl)hex-2-en-4-yn-2-yl]sulfonylbenzene Openeye Name: [(E)-5-methoxy-1-methyl-2-(trifluoromethyl)pent-1-en-3-ynyl]sulfonylbenzene CAS Name: [(E)-6-methoxy-3-(trifluoromethyl)hex-2-en-4-yn-2-yl]sulfonylbenzene IUPAC Name: [(E)-6-methoxy-3-(trifluoromethyl)hex-2-en-4-yn-2-yl]sulfonylbenzene Traditional Name: [(E)-5-methoxy-1-methyl-2-(trifluoromethyl)pent-1-en-3-ynyl]sulfonylbenzene Formula: C14H13F3O3S MolecularWeight: 318.31143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#CCOC)C(F)(F)F)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

C/C(=C(/C#CCOC)\C(F)(F)F)/S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H13F3O3S/c1-11(13(14(15,16)17)9-6-10-20-2)21(18,19)12-7-4-3-5-8-12/h3-5,7-8H,10H2,1-2H3/b13-11+