[5-ethanoyl-2-(2-phenylethynyl)phenyl] ethaneperoxoate

Systemtic Name: [5-ethanoyl-2-(2-phenylethynyl)phenyl] ethaneperoxoate Openeye Name: [5-acetyl-2-(2-phenylethynyl)phenyl] peroxyacetate CAS Name: ethaneperoxoic acid [5-acetyl-2-(2-phenylethynyl)phenyl] ester IUPAC Name: [5-acetyl-2-(2-phenylethynyl)phenyl] ethaneperoxoate Traditional Name: peracetic acid [5-acetyl-2-(2-phenylethynyl)phenyl] ester Formula: C18H14O4 MolecularWeight: 294.30136

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)C#CC2=CC=CC=C2)OOC(=O)C

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)C#CC2=CC=CC=C2)OOC(=O)C

InChI

InChI=1S/C18H14O4/c1-13(19)17-11-10-16(18(12-17)22-21-14(2)20)9-8-15-6-4-3-5-7-15/h3-7,10-12H,1-2H3