2,2-dimethylpropyl 4-hexylbenzenecarboperoxoate

Systemtic Name: 2,2-dimethylpropyl 4-hexylbenzenecarboperoxoate Openeye Name: 2,2-dimethylpropyl 4-hexylbenzenecarboperoxoate CAS Name: 4-hexylbenzenecarboperoxoic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 4-hexylbenzenecarboperoxoate Traditional Name: 4-hexylbenzenecarboperoxoic acid neopentyl ester Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)OOCC(C)(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)OOCC(C)(C)C

InChI

InChI=1S/C18H28O3/c1-5-6-7-8-9-15-10-12-16(13-11-15)17(19)21-20-14-18(2,3)4/h10-13H,5-9,14H2,1-4H3