[4-(chloromethyl)-2-methyl-phenyl] butaneperoxoate

Systemtic Name: [4-(chloromethyl)-2-methyl-phenyl] butaneperoxoate Openeye Name: [4-(chloromethyl)-2-methyl-phenyl] butaneperoxoate CAS Name: butaneperoxoic acid [4-(chloromethyl)-2-methylphenyl] ester IUPAC Name: [4-(chloromethyl)-2-methylphenyl] butaneperoxoate Traditional Name: peroxybutyric acid [4-(chloromethyl)-2-methyl-phenyl] ester Formula: C12H15ClO3 MolecularWeight: 242.6987

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OOC1=C(C=C(C=C1)CCl)C

Isomeric SMILES

CCCC(=O)OOC1=C(C=C(C=C1)CCl)C

InChI

InChI=1S/C12H15ClO3/c1-3-4-12(14)16-15-11-6-5-10(8-13)7-9(11)2/h5-7H,3-4,8H2,1-2H3