tert-butyl 2-cyclohepta-2,4,6-trien-1-ylethaneperoxoate

Systemtic Name: tert-butyl 2-cyclohepta-2,4,6-trien-1-ylethaneperoxoate Openeye Name: tert-butyl 2-cyclohepta-2,4,6-trien-1-ylperoxyacetate CAS Name: 2-(1-cyclohepta-2,4,6-trienyl)ethaneperoxoic acid tert-butyl ester IUPAC Name: tert-butyl 2-cyclohepta-2,4,6-trien-1-ylethaneperoxoate Traditional Name: 2-cyclohepta-2,4,6-trien-1-ylperacetic acid tert-butyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OOC(=O)CC1C=CC=CC=C1

Isomeric SMILES

CC(C)(C)OOC(=O)CC1C=CC=CC=C1

InChI

InChI=1S/C13H18O3/c1-13(2,3)16-15-12(14)10-11-8-6-4-5-7-9-11/h4-9,11H,10H2,1-3H3