2-(dioxidanyl)-4-ethyl-benzoic acid

Systemtic Name: 2-(dioxidanyl)-4-ethyl-benzoic acid Openeye Name: 4-ethyl-2-hydroperoxy-benzoic acid CAS Name: 4-ethyl-2-hydroperoxybenzoic acid IUPAC Name: 4-ethyl-2-hydroperoxybenzoic acid Traditional Name: 4-ethyl-2-hydroperoxy-benzoic acid Formula: C9H10O4 MolecularWeight: 182.1733

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)C(=O)O)OO

Isomeric SMILES

CCC1=CC(=C(C=C1)C(=O)O)OO

InChI

InChI=1S/C9H10O4/c1-2-6-3-4-7(9(10)11)8(5-6)13-12/h3-5,12H,2H2,1H3,(H,10,11)