2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-1-oxido-pyridin-1-ium CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-1-oxidopyridin-1-ium IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-1-oxidopyridin-1-ium Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]-1-oxido-pyridin-1-ium Formula: C13H12FNO2S MolecularWeight: 265.303283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=CC=CC=[N+]2[O-])F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=CC=CC=[N+]2[O-])F

InChI

InChI=1S/C13H12FNO2S/c1-17-12-6-5-10(8-11(12)14)9-18-13-4-2-3-7-15(13)16/h2-8H,9H2,1H3