2,4-ditert-butyl-4-tert-butylperoxy-6-(2-phenylethynyl)cyclohexa-2,5-dien-1-one

Systemtic Name: 2,4-ditert-butyl-4-tert-butylperoxy-6-(2-phenylethynyl)cyclohexa-2,5-dien-1-one Openeye Name: 2,4-ditert-butyl-4-tert-butylperoxy-6-(2-phenylethynyl)cyclohexa-2,5-dien-1-one CAS Name: 2,4-ditert-butyl-4-tert-butyldioxy-6-(2-phenylethynyl)-1-cyclohexa-2,5-dienone IUPAC Name: 2,4-ditert-butyl-4-tert-butylperoxy-6-(2-phenylethynyl)cyclohexa-2,5-dien-1-one Traditional Name: 2,4-ditert-butyl-4-tert-butylperoxy-6-(2-phenylethynyl)cyclohexa-2,5-dien-1-one Formula: C26H34O3 MolecularWeight: 394.54636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34O3/c1-23(2,3)21-18-26(24(4,5)6,29-28-25(7,8)9)17-20(22(21)27)16-15-19-13-11-10-12-14-19/h10-14,17-18H,1-9H3