5,6-dimethoxy-5-methylsulfonyl-cyclohexa-1,3-diene

Systemtic Name: 5,6-dimethoxy-5-methylsulfonyl-cyclohexa-1,3-diene Openeye Name: 5,6-dimethoxy-5-methylsulfonyl-cyclohexa-1,3-diene CAS Name: 5,6-dimethoxy-5-methylsulfonylcyclohexa-1,3-diene IUPAC Name: 5,6-dimethoxy-5-methylsulfonylcyclohexa-1,3-diene Traditional Name: 5-mesyl-5,6-dimethoxy-cyclohexa-1,3-diene Formula: C9H14O4S MolecularWeight: 218.27006

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Descriptors Computed from Structure

Canonical SMILES:

COC1C=CC=CC1(OC)S(=O)(=O)C

Isomeric SMILES

COC1C=CC=CC1(OC)S(=O)(=O)C

InChI

InChI=1S/C9H14O4S/c1-12-8-6-4-5-7-9(8,13-2)14(3,10)11/h4-8H,1-3H3