5-[(3-chloranyl-4-fluoranyl-phenoxy)methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenoxy)methyl]thiophene-2-carboxylic acid Openeye Name: 5-[(3-chloro-4-fluoro-phenoxy)methyl]thiophene-2-carboxylic acid CAS Name: 5-[(3-chloro-4-fluorophenoxy)methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(3-chloro-4-fluorophenoxy)methyl]thiophene-2-carboxylic acid Traditional Name: 5-[(3-chloro-4-fluoro-phenoxy)methyl]-2-thenoic acid Formula: C12H8ClFO3S MolecularWeight: 286.706523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCC2=CC=C(S2)C(=O)O)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1OCC2=CC=C(S2)C(=O)O)Cl)F

InChI

InChI=1S/C12H8ClFO3S/c13-9-5-7(1-3-10(9)14)17-6-8-2-4-11(18-8)12(15)16/h1-5H,6H2,(H,15,16)