ethyl 3-(4-oxidanylbut-1-ynyl)benzenecarboperoxoate

Systemtic Name: ethyl 3-(4-oxidanylbut-1-ynyl)benzenecarboperoxoate Openeye Name: ethyl 3-(4-hydroxybut-1-ynyl)benzenecarboperoxoate CAS Name: 3-(4-hydroxybut-1-ynyl)benzenecarboperoxoic acid ethyl ester IUPAC Name: ethyl 3-(4-hydroxybut-1-ynyl)benzenecarboperoxoate Traditional Name: 3-(4-hydroxybut-1-ynyl)benzenecarboperoxoic acid ethyl ester Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

CCOOC(=O)C1=CC=CC(=C1)C#CCCO

Isomeric SMILES

CCOOC(=O)C1=CC=CC(=C1)C#CCCO

InChI

InChI=1S/C13H14O4/c1-2-16-17-13(15)12-8-5-7-11(10-12)6-3-4-9-14/h5,7-8,10,14H,2,4,9H2,1H3