phenyl 2,2-dimethyl-3-pentoxy-3-pyridin-2-ylsulfanyl-hexaneperoxoate

Systemtic Name: phenyl 2,2-dimethyl-3-pentoxy-3-pyridin-2-ylsulfanyl-hexaneperoxoate Openeye Name: phenyl 2,2-dimethyl-3-pentoxy-3-(2-pyridylsulfanyl)hexaneperoxoate CAS Name: 2,2-dimethyl-3-pentoxy-3-(2-pyridinylthio)hexaneperoxoic acid phenyl ester IUPAC Name: phenyl 2,2-dimethyl-3-pentoxy-3-pyridin-2-ylsulfanylhexaneperoxoate Traditional Name: 3-amoxy-2,2-dimethyl-3-(2-pyridylthio)hexaneperoxoic acid phenyl ester Formula: C24H33NO4S MolecularWeight: 431.58812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(CCC)(C(C)(C)C(=O)OOC1=CC=CC=C1)SC2=CC=CC=N2

Isomeric SMILES

CCCCCOC(CCC)(C(C)(C)C(=O)OOC1=CC=CC=C1)SC2=CC=CC=N2

InChI

InChI=1S/C24H33NO4S/c1-5-7-13-19-27-24(17-6-2,30-21-16-11-12-18-25-21)23(3,4)22(26)29-28-20-14-9-8-10-15-20/h8-12,14-16,18H,5-7,13,17,19H2,1-4H3