[2-(1-hydroxyethyl)-5-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)butaneperoxoate

Systemtic Name: [2-(1-hydroxyethyl)-5-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)butaneperoxoate Openeye Name: [2-(1-hydroxyethyl)-5-(3-thienylmethoxy)phenyl] 4-(o-tolyl)butaneperoxoate CAS Name: 4-(2-methylphenyl)butaneperoxoic acid [2-(1-hydroxyethyl)-5-(3-thiophenylmethoxy)phenyl] ester IUPAC Name: [2-(1-hydroxyethyl)-5-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)butaneperoxoate Traditional Name: 4-(o-tolyl)peroxybutyric acid [2-(1-hydroxyethyl)-5-(3-thenyloxy)phenyl] ester Formula: C24H26O5S MolecularWeight: 426.52524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCCC(=O)OOC2=C(C=CC(=C2)OCC3=CSC=C3)C(C)O

Isomeric SMILES

CC1=CC=CC=C1CCCC(=O)OOC2=C(C=CC(=C2)OCC3=CSC=C3)C(C)O

InChI

InChI=1S/C24H26O5S/c1-17-6-3-4-7-20(17)8-5-9-24(26)29-28-23-14-21(10-11-22(23)18(2)25)27-15-19-12-13-30-16-19/h3-4,6-7,10-14,16,18,25H,5,8-9,15H2,1-2H3