2-butyl-4-methyl-benzenecarboperoxoic acid

Systemtic Name: 2-butyl-4-methyl-benzenecarboperoxoic acid Openeye Name: 2-butyl-4-methyl-benzenecarboperoxoic acid CAS Name: 2-butyl-4-methylbenzenecarboperoxoic acid IUPAC Name: 2-butyl-4-methylbenzenecarboperoxoic acid Traditional Name: 2-butyl-4-methyl-perbenzoic acid Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C)C(=O)OO

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C)C(=O)OO

InChI

InChI=1S/C12H16O3/c1-3-4-5-10-8-9(2)6-7-11(10)12(13)15-14/h6-8,14H,3-5H2,1-2H3