[1-[3-methyl-3-(2-methylbutan-2-ylperoxy)but-1-ynyl]cyclopentyl] benzoate

Systemtic Name: [1-[3-methyl-3-(2-methylbutan-2-ylperoxy)but-1-ynyl]cyclopentyl] benzoate Openeye Name: [1-[3-(1,1-dimethylpropylperoxy)-3-methyl-but-1-ynyl]cyclopentyl] benzoate CAS Name: benzoic acid [1-[3-methyl-3-(2-methylbutan-2-yldioxy)but-1-ynyl]cyclopentyl] ester IUPAC Name: [1-[3-methyl-3-(2-methylbutan-2-ylperoxy)but-1-ynyl]cyclopentyl] benzoate Traditional Name: benzoic acid [1-(3-tert-amylperoxy-3-methyl-but-1-ynyl)cyclopentyl] ester Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OOC(C)(C)C#CC1(CCCC1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(C)(C)OOC(C)(C)C#CC1(CCCC1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H30O4/c1-6-20(2,3)25-26-21(4,5)16-17-22(14-10-11-15-22)24-19(23)18-12-8-7-9-13-18/h7-9,12-13H,6,10-11,14-15H2,1-5H3