(4-chloranylsulfonyl-2-methyl-phenyl) butaneperoxoate

Systemtic Name: (4-chloranylsulfonyl-2-methyl-phenyl) butaneperoxoate Openeye Name: (4-chlorosulfonyl-2-methyl-phenyl) butaneperoxoate CAS Name: butaneperoxoic acid (4-chlorosulfonyl-2-methylphenyl) ester IUPAC Name: (4-chlorosulfonyl-2-methylphenyl) butaneperoxoate Traditional Name: peroxybutyric acid (4-chlorosulfonyl-2-methyl-phenyl) ester Formula: C11H13ClO5S MolecularWeight: 292.73592

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OOC1=C(C=C(C=C1)S(=O)(=O)Cl)C

Isomeric SMILES

CCCC(=O)OOC1=C(C=C(C=C1)S(=O)(=O)Cl)C

InChI

InChI=1S/C11H13ClO5S/c1-3-4-11(13)17-16-10-6-5-9(7-8(10)2)18(12,14)15/h5-7H,3-4H2,1-2H3