(1R,4S)-4-acetyloxy-3,3-bis(fluoranyl)cyclohexane-1-carboxylic acid

Systemtic Name: (1R,4S)-4-acetyloxy-3,3-bis(fluoranyl)cyclohexane-1-carboxylic acid Openeye Name: (1R,4S)-4-acetoxy-3,3-difluoro-cyclohexanecarboxylic acid CAS Name: (1R,4S)-4-acetyloxy-3,3-difluoro-1-cyclohexanecarboxylic acid IUPAC Name: (1R,4S)-4-acetyloxy-3,3-difluorocyclohexane-1-carboxylic acid Traditional Name: (1R,4S)-4-acetoxy-3,3-difluoro-cyclohexanecarboxylic acid Formula: C9H12F2O4 MolecularWeight: 222.185986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC(CC1(F)F)C(=O)O

Isomeric SMILES

CC(=O)O[C@H]1CC[C@H](CC1(F)F)C(=O)O

InChI

InChI=1S/C9H12F2O4/c1-5(12)15-7-3-2-6(8(13)14)4-9(7,10)11/h6-7H,2-4H2,1H3,(H,13,14)/t6-,7+/m1/s1