hexan-2-yl benzenecarboperoxoate

Systemtic Name: hexan-2-yl benzenecarboperoxoate Openeye Name: 1-methylpentyl benzenecarboperoxoate CAS Name: benzenecarboperoxoic acid hexan-2-yl ester IUPAC Name: hexan-2-yl benzenecarboperoxoate Traditional Name: benzenecarboperoxoic acid 1-methylpentyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)OOC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCC(C)OOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H18O3/c1-3-4-8-11(2)15-16-13(14)12-9-6-5-7-10-12/h5-7,9-11H,3-4,8H2,1-2H3