2-(4-sulfonylcyclohexa-1,5-dien-1-yl)ethanoate

Systemtic Name: 2-(4-sulfonylcyclohexa-1,5-dien-1-yl)ethanoate Openeye Name: 2-(4-sulfonylcyclohexa-1,5-dien-1-yl)acetate CAS Name: 2-(4-sulfonyl-1-cyclohexa-1,5-dienyl)acetate IUPAC Name: 2-(4-sulfonylcyclohexa-1,5-dien-1-yl)acetate Traditional Name: 2-(4-sulfonylcyclohexa-1,5-dien-1-yl)acetate Formula: C8H7O4S- MolecularWeight: 199.20378

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=CC1=S(=O)=O)CC(=O)[O-]

Isomeric SMILES

C1C=C(C=CC1=S(=O)=O)CC(=O)[O-]

InChI

InChI=1S/C8H8O4S/c9-8(10)5-6-1-3-7(4-2-6)13(11)12/h1-3H,4-5H2,(H,9,10)/p-1