[3-(thiophen-3-ylmethoxy)phenyl] 3-oxidanylidene-2-phenethyl-butaneperoxoate

Systemtic Name: [3-(thiophen-3-ylmethoxy)phenyl] 3-oxidanylidene-2-phenethyl-butaneperoxoate Openeye Name: [3-(3-thienylmethoxy)phenyl] 3-oxo-2-phenethyl-butaneperoxoate CAS Name: 3-oxo-2-phenethylbutaneperoxoic acid [3-(3-thiophenylmethoxy)phenyl] ester IUPAC Name: [3-(thiophen-3-ylmethoxy)phenyl] 3-oxo-2-phenethylbutaneperoxoate Traditional Name: 3-keto-2-phenethyl-peroxybutyric acid [3-(3-thenyloxy)phenyl] ester Formula: C23H22O5S MolecularWeight: 410.48278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC1=CC=CC=C1)C(=O)OOC2=CC=CC(=C2)OCC3=CSC=C3

Isomeric SMILES

CC(=O)C(CCC1=CC=CC=C1)C(=O)OOC2=CC=CC(=C2)OCC3=CSC=C3

InChI

InChI=1S/C23H22O5S/c1-17(24)22(11-10-18-6-3-2-4-7-18)23(25)28-27-21-9-5-8-20(14-21)26-15-19-12-13-29-16-19/h2-9,12-14,16,22H,10-11,15H2,1H3