2-[(1R,4S)-4-(dioxidanyl)-4-methyl-cyclohex-2-en-1-yl]propan-2-yl ethanoate

Systemtic Name: 2-[(1R,4S)-4-(dioxidanyl)-4-methyl-cyclohex-2-en-1-yl]propan-2-yl ethanoate Openeye Name: [1-[(1R,4S)-4-hydroperoxy-4-methyl-cyclohex-2-en-1-yl]-1-methyl-ethyl] acetate CAS Name: acetic acid 2-[(1R,4S)-4-hydroperoxy-4-methyl-1-cyclohex-2-enyl]propan-2-yl ester IUPAC Name: 2-[(1R,4S)-4-hydroperoxy-4-methylcyclohex-2-en-1-yl]propan-2-yl acetate Traditional Name: acetic acid [1-[(1R,4S)-4-hydroperoxy-4-methyl-cyclohex-2-en-1-yl]-1-methyl-ethyl] ester Formula: C12H20O4 MolecularWeight: 228.2848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C)(C)C1CCC(C=C1)(C)OO

Isomeric SMILES

CC(=O)OC(C)(C)[C@@H]1CC[C@](C=C1)(C)OO

InChI

InChI=1S/C12H20O4/c1-9(13)15-11(2,3)10-5-7-12(4,16-14)8-6-10/h5,7,10,14H,6,8H2,1-4H3/t10-,12+/m0/s1