[3-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)-2-(1,3-oxazol-2-yl)butaneperoxoate

Systemtic Name: [3-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)-2-(1,3-oxazol-2-yl)butaneperoxoate Openeye Name: [3-(3-thienylmethoxy)phenyl] 4-(o-tolyl)-2-oxazol-2-yl-butaneperoxoate CAS Name: 4-(2-methylphenyl)-2-(2-oxazolyl)butaneperoxoic acid [3-(3-thiophenylmethoxy)phenyl] ester IUPAC Name: [3-(thiophen-3-ylmethoxy)phenyl] 4-(2-methylphenyl)-2-(1,3-oxazol-2-yl)butaneperoxoate Traditional Name: 4-(o-tolyl)-2-oxazol-2-yl-peroxybutyric acid [3-(3-thenyloxy)phenyl] ester Formula: C25H23NO5S MolecularWeight: 449.51882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(C2=NC=CO2)C(=O)OOC3=CC=CC(=C3)OCC4=CSC=C4

Isomeric SMILES

CC1=CC=CC=C1CCC(C2=NC=CO2)C(=O)OOC3=CC=CC(=C3)OCC4=CSC=C4

InChI

InChI=1S/C25H23NO5S/c1-18-5-2-3-6-20(18)9-10-23(24-26-12-13-28-24)25(27)31-30-22-8-4-7-21(15-22)29-16-19-11-14-32-17-19/h2-8,11-15,17,23H,9-10,16H2,1H3