4-(4-chloranyl-3-fluoranyl-phenyl)cyclohexane-1-carboxylic acid

Systemtic Name: 4-(4-chloranyl-3-fluoranyl-phenyl)cyclohexane-1-carboxylic acid Openeye Name: 4-(4-chloro-3-fluoro-phenyl)cyclohexanecarboxylic acid CAS Name: 4-(4-chloro-3-fluorophenyl)-1-cyclohexanecarboxylic acid IUPAC Name: 4-(4-chloro-3-fluorophenyl)cyclohexane-1-carboxylic acid Traditional Name: 4-(4-chloro-3-fluoro-phenyl)cyclohexanecarboxylic acid Formula: C13H14ClFO2 MolecularWeight: 256.700463

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC(=C(C=C2)Cl)F)C(=O)O

Isomeric SMILES

C1CC(CCC1C2=CC(=C(C=C2)Cl)F)C(=O)O

InChI

InChI=1S/C13H14ClFO2/c14-11-6-5-10(7-12(11)15)8-1-3-9(4-2-8)13(16)17/h5-9H,1-4H2,(H,16,17)