2-[(1S,2S)-2-tert-butylcyclohexyl]ethanoate

Systemtic Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]ethanoate Openeye Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]acetate CAS Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]acetate IUPAC Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]acetate Traditional Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]acetate Formula: C12H21O2- MolecularWeight: 197.29394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCCCC1CC(=O)[O-]

Isomeric SMILES

CC(C)(C)[C@H]1CCCC[C@H]1CC(=O)[O-]

InChI

InChI=1S/C12H22O2/c1-12(2,3)10-7-5-4-6-9(10)8-11(13)14/h9-10H,4-8H2,1-3H3,(H,13,14)/p-1/t9-,10-/m0/s1