(3,4-dithiophen-2-ylphenyl) 2-(1,3-oxazol-2-yl)butaneperoxoate

Systemtic Name: (3,4-dithiophen-2-ylphenyl) 2-(1,3-oxazol-2-yl)butaneperoxoate Openeye Name: [3,4-bis(2-thienyl)phenyl] 2-oxazol-2-ylbutaneperoxoate CAS Name: 2-(2-oxazolyl)butaneperoxoic acid (3,4-dithiophen-2-ylphenyl) ester IUPAC Name: (3,4-dithiophen-2-ylphenyl) 2-(1,3-oxazol-2-yl)butaneperoxoate Traditional Name: 2-oxazol-2-ylperoxybutyric acid [3,4-bis(2-thienyl)phenyl] ester Formula: C21H17NO4S2 MolecularWeight: 411.49398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC=CO1)C(=O)OOC2=CC(=C(C=C2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CCC(C1=NC=CO1)C(=O)OOC2=CC(=C(C=C2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C21H17NO4S2/c1-2-15(20-22-9-10-24-20)21(23)26-25-14-7-8-16(18-5-3-11-27-18)17(13-14)19-6-4-12-28-19/h3-13,15H,2H2,1H3