methyl (1S,2S,4R)-2-(4-fluorophenyl)-4-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,2S,4R)-2-(4-fluorophenyl)-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: methyl (1S,2S,4R)-2-(4-fluorophenyl)-4-hydroxy-cyclohexanecarboxylate CAS Name: (1S,2S,4R)-2-(4-fluorophenyl)-4-hydroxy-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2S,4R)-2-(4-fluorophenyl)-4-hydroxycyclohexane-1-carboxylate Traditional Name: (1S,2S,4R)-2-(4-fluorophenyl)-4-hydroxy-cyclohexanecarboxylic acid methyl ester Formula: C14H17FO3 MolecularWeight: 252.281383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1C2=CC=C(C=C2)F)O

Isomeric SMILES

COC(=O)[C@H]1CC[C@H](C[C@@H]1C2=CC=C(C=C2)F)O

InChI

InChI=1S/C14H17FO3/c1-18-14(17)12-7-6-11(16)8-13(12)9-2-4-10(15)5-3-9/h2-5,11-13,16H,6-8H2,1H3/t11-,12+,13-/m1/s1