octan-2-yl 4-hexylbenzenecarboperoxoate

Systemtic Name: octan-2-yl 4-hexylbenzenecarboperoxoate Openeye Name: 1-methylheptyl 4-hexylbenzenecarboperoxoate CAS Name: 4-hexylbenzenecarboperoxoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-hexylbenzenecarboperoxoate Traditional Name: 4-hexylbenzenecarboperoxoic acid 1-methylheptyl ester Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)OOC(C)CCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)OOC(C)CCCCCC

InChI

InChI=1S/C21H34O3/c1-4-6-8-10-12-18(3)23-24-21(22)20-16-14-19(15-17-20)13-11-9-7-5-2/h14-18H,4-13H2,1-3H3