ethyl 3-chloranylsulfonyl-4,5-dimethyl-benzoate

Systemtic Name: ethyl 3-chloranylsulfonyl-4,5-dimethyl-benzoate Openeye Name: ethyl 3-chlorosulfonyl-4,5-dimethyl-benzoate CAS Name: 3-chlorosulfonyl-4,5-dimethylbenzoic acid ethyl ester IUPAC Name: ethyl 3-chlorosulfonyl-4,5-dimethylbenzoate Traditional Name: 3-chlorosulfonyl-4,5-dimethyl-benzoic acid ethyl ester Formula: C11H13ClO4S MolecularWeight: 276.73652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)S(=O)(=O)Cl)C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)S(=O)(=O)Cl)C)C

InChI

InChI=1S/C11H13ClO4S/c1-4-16-11(13)9-5-7(2)8(3)10(6-9)17(12,14)15/h5-6H,4H2,1-3H3