[2-(hydroxymethyl)-2-methyl-3-[(3-methylcyclohexyl)methylperoxy]propyl] 3-methylcyclohexane-1-carboxylate

Systemtic Name: [2-(hydroxymethyl)-2-methyl-3-[(3-methylcyclohexyl)methylperoxy]propyl] 3-methylcyclohexane-1-carboxylate Openeye Name: [2-(hydroxymethyl)-2-methyl-3-[(3-methylcyclohexyl)methylperoxy]propyl] 3-methylcyclohexanecarboxylate CAS Name: 3-methyl-1-cyclohexanecarboxylic acid [2-(hydroxymethyl)-2-methyl-3-[(3-methylcyclohexyl)methyldioxy]propyl] ester IUPAC Name: [2-(hydroxymethyl)-2-methyl-3-[(3-methylcyclohexyl)methylperoxy]propyl] 3-methylcyclohexane-1-carboxylate Traditional Name: 3-methylcyclohexanecarboxylic acid [3-hydroxy-2-methyl-2-[(3-methylcyclohexyl)methylperoxymethyl]propyl] ester Formula: C21H38O5 MolecularWeight: 370.52342

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)COOCC(C)(CO)COC(=O)C2CCCC(C2)C

Isomeric SMILES

CC1CCCC(C1)COOCC(C)(CO)COC(=O)C2CCCC(C2)C

InChI

InChI=1S/C21H38O5/c1-16-6-4-8-18(10-16)12-25-26-15-21(3,13-22)14-24-20(23)19-9-5-7-17(2)11-19/h16-19,22H,4-15H2,1-3H3