5-(methylsulfonylmethyl)cyclohexa-1,3-diene; perchloric acid

Systemtic Name: 5-(methylsulfonylmethyl)cyclohexa-1,3-diene; perchloric acid Openeye Name: 5-(methylsulfonylmethyl)cyclohexa-1,3-diene; perchloric acid CAS Name: 5-(methylsulfonylmethyl)cyclohexa-1,3-diene; perchloric acid IUPAC Name: 5-(methylsulfonylmethyl)cyclohexa-1,3-diene; perchloric acid Traditional Name: 5-(mesylmethyl)cyclohexa-1,3-diene; perchloric acid Formula: C8H13ClO6S MolecularWeight: 272.70322

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1CC=CC=C1.OCl(=O)(=O)=O

Isomeric SMILES

CS(=O)(=O)CC1CC=CC=C1.OCl(=O)(=O)=O

InChI

InChI=1S/C8H12O2S.ClHO4/c1-11(9,10)7-8-5-3-2-4-6-8;2-1(3,4)5/h2-5,8H,6-7H2,1H3;(H,2,3,4,5)