methyl 2-(4-chloranyl-2,5-dimethyl-phenyl)sulfonylethanoate

Systemtic Name: methyl 2-(4-chloranyl-2,5-dimethyl-phenyl)sulfonylethanoate Openeye Name: methyl 2-(4-chloro-2,5-dimethyl-phenyl)sulfonylacetate CAS Name: 2-(4-chloro-2,5-dimethylphenyl)sulfonylacetic acid methyl ester IUPAC Name: methyl 2-(4-chloro-2,5-dimethylphenyl)sulfonylacetate Traditional Name: 2-(4-chloro-2,5-dimethyl-phenyl)sulfonylacetic acid methyl ester Formula: C11H13ClO4S MolecularWeight: 276.73652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)CC(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)CC(=O)OC

InChI

InChI=1S/C11H13ClO4S/c1-7-5-10(8(2)4-9(7)12)17(14,15)6-11(13)16-3/h4-5H,6H2,1-3H3