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2-octyloctadecaneperoxoic acid dibenzoate

2-octyloctadecaneperoxoic acid dibenzoate

Systemtic Name:2-octyloctadecaneperoxoic acid dibenzoate
Openeye Name:2-octyloctadecaneperoxoic acid dibenzoate
CAS Name:2-octyloctadecaneperoxoic acid dibenzoate
IUPAC Name:2-octyloctadecaneperoxoic acid dibenzoate
Traditional Name:2-octylperoxystearic acid dibenzoate
Formula: C40H62O7-2
MolecularWeight: 654.91608
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCCCCCCC)C(=O)OO.C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCCCCCCC)C(=O)OO.C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-]


InChI

InChI=1S/C26H52O3.2C7H6O2/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-25(26(27)29-28)23-21-19-10-8-6-4-2;2*8-7(9)6-4-2-1-3-5-6/h25,28H,3-24H2,1-2H3;2*1-5H,(H,8,9)/p-2


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