4-(2-chloranyl-6-fluoranyl-phenyl)oxane-4-carboxylic acid

Systemtic Name: 4-(2-chloranyl-6-fluoranyl-phenyl)oxane-4-carboxylic acid Openeye Name: 4-(2-chloro-6-fluoro-phenyl)tetrahydropyran-4-carboxylic acid CAS Name: 4-(2-chloro-6-fluorophenyl)-4-oxanecarboxylic acid IUPAC Name: 4-(2-chloro-6-fluorophenyl)oxane-4-carboxylic acid Traditional Name: 4-(2-chloro-6-fluoro-phenyl)tetrahydropyran-4-carboxylic acid Formula: C12H12ClFO3 MolecularWeight: 258.673283

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2=C(C=CC=C2Cl)F)C(=O)O

Isomeric SMILES

C1COCCC1(C2=C(C=CC=C2Cl)F)C(=O)O

InChI

InChI=1S/C12H12ClFO3/c13-8-2-1-3-9(14)10(8)12(11(15)16)4-6-17-7-5-12/h1-3H,4-7H2,(H,15,16)