4-[2-(dioxidanyl)propan-2-yl]benzoic acid

Systemtic Name: 4-[2-(dioxidanyl)propan-2-yl]benzoic acid Openeye Name: 4-(1-hydroperoxy-1-methyl-ethyl)benzoic acid CAS Name: 4-(2-hydroperoxypropan-2-yl)benzoic acid IUPAC Name: 4-(2-hydroperoxypropan-2-yl)benzoic acid Traditional Name: 4-(1-hydroperoxy-1-methyl-ethyl)benzoic acid Formula: C10H12O4 MolecularWeight: 196.19988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C(=O)O)OO

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C(=O)O)OO

InChI

InChI=1S/C10H12O4/c1-10(2,14-13)8-5-3-7(4-6-8)9(11)12/h3-6,13H,1-2H3,(H,11,12)