4-(3-methylphenyl)peroxybutane-2-sulfonic acid

Systemtic Name: 4-(3-methylphenyl)peroxybutane-2-sulfonic acid Openeye Name: 4-(m-tolylperoxy)butane-2-sulfonic acid CAS Name: 4-(3-methylphenyl)dioxy-2-butanesulfonic acid IUPAC Name: 4-(3-methylphenyl)peroxybutane-2-sulfonic acid Traditional Name: 4-(m-tolylperoxy)butane-2-sulfonic acid Formula: C11H16O5S MolecularWeight: 260.30674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OOCCC(C)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OOCCC(C)S(=O)(=O)O

InChI

InChI=1S/C11H16O5S/c1-9-4-3-5-11(8-9)16-15-7-6-10(2)17(12,13)14/h3-5,8,10H,6-7H2,1-2H3,(H,12,13,14)