hexyl 3-methylbenzenecarboperoxoate

Systemtic Name: hexyl 3-methylbenzenecarboperoxoate Openeye Name: hexyl 3-methylbenzenecarboperoxoate CAS Name: 3-methylbenzenecarboperoxoic acid hexyl ester IUPAC Name: hexyl 3-methylbenzenecarboperoxoate Traditional Name: 3-methylbenzenecarboperoxoic acid hexyl ester Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOOC(=O)C1=CC(=CC=C1)C

Isomeric SMILES

CCCCCCOOC(=O)C1=CC(=CC=C1)C

InChI

InChI=1S/C14H20O3/c1-3-4-5-6-10-16-17-14(15)13-9-7-8-12(2)11-13/h7-9,11H,3-6,10H2,1-2H3