5-[[3-(trifluoromethyl)phenyl]methylsulfinyl]pyridine-2-carboxylic acid

Systemtic Name: 5-[[3-(trifluoromethyl)phenyl]methylsulfinyl]pyridine-2-carboxylic acid Openeye Name: 5-[[3-(trifluoromethyl)phenyl]methylsulfinyl]pyridine-2-carboxylic acid CAS Name: 5-[[3-(trifluoromethyl)phenyl]methylsulfinyl]-2-pyridinecarboxylic acid IUPAC Name: 5-[[3-(trifluoromethyl)phenyl]methylsulfinyl]pyridine-2-carboxylic acid Traditional Name: 5-[3-(trifluoromethyl)benzyl]sulfinylpicolinic acid Formula: C14H10F3NO3S MolecularWeight: 329.29431

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CS(=O)C2=CN=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CS(=O)C2=CN=C(C=C2)C(=O)O

InChI

InChI=1S/C14H10F3NO3S/c15-14(16,17)10-3-1-2-9(6-10)8-22(21)11-4-5-12(13(19)20)18-7-11/h1-7H,8H2,(H,19,20)