2-(3,4-dimethylphenyl)sulfonylethanoate

Systemtic Name: 2-(3,4-dimethylphenyl)sulfonylethanoate Openeye Name: 2-(3,4-dimethylphenyl)sulfonylacetate CAS Name: 2-(3,4-dimethylphenyl)sulfonylacetate IUPAC Name: 2-(3,4-dimethylphenyl)sulfonylacetate Traditional Name: 2-(3,4-dimethylphenyl)sulfonylacetate Formula: C10H11O4S- MolecularWeight: 227.25694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)CC(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)CC(=O)[O-])C

InChI

InChI=1S/C10H12O4S/c1-7-3-4-9(5-8(7)2)15(13,14)6-10(11)12/h3-5H,6H2,1-2H3,(H,11,12)/p-1