1-methyl-5-sulfonyl-cyclohexa-1,3-diene

Systemtic Name: 1-methyl-5-sulfonyl-cyclohexa-1,3-diene Openeye Name: 1-methyl-5-sulfonyl-cyclohexa-1,3-diene CAS Name: 1-methyl-5-sulfonylcyclohexa-1,3-diene IUPAC Name: 1-methyl-5-sulfonylcyclohexa-1,3-diene Traditional Name: 1-methyl-5-sulfonyl-cyclohexa-1,3-diene Formula: C7H8O2S MolecularWeight: 156.20222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=S(=O)=O)C1

Isomeric SMILES

CC1=CC=CC(=S(=O)=O)C1

InChI

InChI=1S/C7H8O2S/c1-6-3-2-4-7(5-6)10(8)9/h2-4H,5H2,1H3