(3R,5R)-3,5-bis(trifluoromethyl)cyclohexane-1-carboxylate

Systemtic Name: (3R,5R)-3,5-bis(trifluoromethyl)cyclohexane-1-carboxylate Openeye Name: (3R,5R)-3,5-bis(trifluoromethyl)cyclohexanecarboxylate CAS Name: (3R,5R)-3,5-bis(trifluoromethyl)-1-cyclohexanecarboxylate IUPAC Name: (3R,5R)-3,5-bis(trifluoromethyl)cyclohexane-1-carboxylate Traditional Name: (3R,5R)-3,5-bis(trifluoromethyl)cyclohexanecarboxylate Formula: C9H9F6O2- MolecularWeight: 263.156979

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(CC1C(F)(F)F)C(F)(F)F)C(=O)[O-]

Isomeric SMILES

C1[C@@H](CC(C[C@H]1C(F)(F)F)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C9H10F6O2/c10-8(11,12)5-1-4(7(16)17)2-6(3-5)9(13,14)15/h4-6H,1-3H2,(H,16,17)/p-1/t5-,6-/m1/s1