2-[(1S,2S)-2-tert-butylcyclohexyl]ethanoic acid

Systemtic Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]ethanoic acid Openeye Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]acetic acid CAS Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]acetic acid IUPAC Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]acetic acid Traditional Name: 2-[(1S,2S)-2-tert-butylcyclohexyl]acetic acid Formula: C12H22O2 MolecularWeight: 198.30188

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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)/t9-,10-/m0/s1