ethyl 4-[3-[3-(5-methylsulfonyloxypentylperoxy)-3-oxidanylidene-propyl]phenoxy]butanoate

Systemtic Name: ethyl 4-[3-[3-(5-methylsulfonyloxypentylperoxy)-3-oxidanylidene-propyl]phenoxy]butanoate Openeye Name: ethyl 4-[3-[3-(5-methylsulfonyloxypentylperoxy)-3-oxo-propyl]phenoxy]butanoate CAS Name: 4-[3-[3-(5-methylsulfonyloxypentyldioxy)-3-oxopropyl]phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-[3-(5-methylsulfonyloxypentylperoxy)-3-oxopropyl]phenoxy]butanoate Traditional Name: 4-[3-[3-keto-3-(5-methylsulfonyloxypentylperoxy)propyl]phenoxy]butyric acid ethyl ester Formula: C21H32O9S MolecularWeight: 460.53838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC=CC(=C1)CCC(=O)OOCCCCCOS(=O)(=O)C

Isomeric SMILES

CCOC(=O)CCCOC1=CC=CC(=C1)CCC(=O)OOCCCCCOS(=O)(=O)C

InChI

InChI=1S/C21H32O9S/c1-3-26-20(22)11-8-14-27-19-10-7-9-18(17-19)12-13-21(23)30-28-15-5-4-6-16-29-31(2,24)25/h7,9-10,17H,3-6,8,11-16H2,1-2H3