2-(4-propan-2-ylphenyl)propan-2-yl 3-(5,5-dimethylhexyl)-1,2-dioxirane-3-carboxylate

Systemtic Name: 2-(4-propan-2-ylphenyl)propan-2-yl 3-(5,5-dimethylhexyl)-1,2-dioxirane-3-carboxylate Openeye Name: [1-(4-isopropylphenyl)-1-methyl-ethyl] 3-(5,5-dimethylhexyl)dioxirane-3-carboxylate CAS Name: 3-(5,5-dimethylhexyl)-3-dioxiranecarboxylic acid 2-(4-propan-2-ylphenyl)propan-2-yl ester IUPAC Name: 2-(4-propan-2-ylphenyl)propan-2-yl 3-(5,5-dimethylhexyl)dioxirane-3-carboxylate Traditional Name: 3-(5,5-dimethylhexyl)dioxirane-3-carboxylic acid (1-methyl-1-p-cumenyl-ethyl) ester Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C)(C)OC(=O)C2(OO2)CCCCC(C)(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C)(C)OC(=O)C2(OO2)CCCCC(C)(C)C

InChI

InChI=1S/C22H34O4/c1-16(2)17-10-12-18(13-11-17)21(6,7)24-19(23)22(25-26-22)15-9-8-14-20(3,4)5/h10-13,16H,8-9,14-15H2,1-7H3