(1E,5E,9E)-1-(methylsulfonylmethyl)cyclododeca-1,5,9-triene

Systemtic Name: (1E,5E,9E)-1-(methylsulfonylmethyl)cyclododeca-1,5,9-triene Openeye Name: (1E,5E,9E)-1-(methylsulfonylmethyl)cyclododeca-1,5,9-triene CAS Name: (1E,5E,9E)-1-(methylsulfonylmethyl)cyclododeca-1,5,9-triene IUPAC Name: (1E,5E,9E)-1-(methylsulfonylmethyl)cyclododeca-1,5,9-triene Traditional Name: (1E,5E,9E)-1-(mesylmethyl)cyclododeca-1,5,9-triene Formula: C14H22O2S MolecularWeight: 254.38828

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CCCC=CCCC=CCC1

Isomeric SMILES

CS(=O)(=O)C/C/1=C/CC/C=C/CC/C=C/CC1

InChI

InChI=1S/C14H22O2S/c1-17(15,16)13-14-11-9-7-5-3-2-4-6-8-10-12-14/h3,5-6,8,11H,2,4,7,9-10,12-13H2,1H3/b5-3+,8-6+,14-11+