methyl 2-[(1S,2S,3S,5R)-5-acetyloxy-2-methyl-3-oxidanyl-cyclohexyl]ethanoate

Systemtic Name: methyl 2-[(1S,2S,3S,5R)-5-acetyloxy-2-methyl-3-oxidanyl-cyclohexyl]ethanoate Openeye Name: methyl 2-[(1S,2S,3S,5R)-5-acetoxy-3-hydroxy-2-methyl-cyclohexyl]acetate CAS Name: 2-[(1S,2S,3S,5R)-5-acetyloxy-3-hydroxy-2-methylcyclohexyl]acetic acid methyl ester IUPAC Name: methyl 2-[(1S,2S,3S,5R)-5-acetyloxy-3-hydroxy-2-methylcyclohexyl]acetate Traditional Name: 2-[(1S,2S,3S,5R)-5-acetoxy-3-hydroxy-2-methyl-cyclohexyl]acetic acid methyl ester Formula: C12H20O5 MolecularWeight: 244.2842

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(CC1O)OC(=O)C)CC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C12H20O5/c1-7-9(5-12(15)16-3)4-10(6-11(7)14)17-8(2)13/h7,9-11,14H,4-6H2,1-3H3/t7-,9-,10+,11-/m0/s1