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

Systemtic Name: (4-chloranylsulfonyl-2-propyl-phenyl) butaneperoxoate Openeye Name: (4-chlorosulfonyl-2-propyl-phenyl) butaneperoxoate CAS Name: butaneperoxoic acid (4-chlorosulfonyl-2-propylphenyl) ester IUPAC Name: (4-chlorosulfonyl-2-propylphenyl) butaneperoxoate Traditional Name: peroxybutyric acid (4-chlorosulfonyl-2-propyl-phenyl) ester Formula: C13H17ClO5S MolecularWeight: 320.78908

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)S(=O)(=O)Cl)OOC(=O)CCC

Isomeric SMILES

CCCC1=C(C=CC(=C1)S(=O)(=O)Cl)OOC(=O)CCC

InChI

InChI=1S/C13H17ClO5S/c1-3-5-10-9-11(20(14,16)17)7-8-12(10)18-19-13(15)6-4-2/h7-9H,3-6H2,1-2H3