2-[[3-[bis(fluoranyl)methoxy]phenyl]methylsulfonyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[[3-[bis(fluoranyl)methoxy]phenyl]methylsulfonyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-[[3-(difluoromethoxy)phenyl]methylsulfonyl]-1-oxido-pyridin-1-ium CAS Name: 2-[[3-(difluoromethoxy)phenyl]methylsulfonyl]-1-oxidopyridin-1-ium IUPAC Name: 2-[[3-(difluoromethoxy)phenyl]methylsulfonyl]-1-oxidopyridin-1-ium Traditional Name: 2-[3-(difluoromethoxy)benzyl]sulfonyl-1-oxido-pyridin-1-ium Formula: C13H11F2NO4S MolecularWeight: 315.292546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)S(=O)(=O)CC2=CC(=CC=C2)OC(F)F)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)S(=O)(=O)CC2=CC(=CC=C2)OC(F)F)[O-]

InChI

InChI=1S/C13H11F2NO4S/c14-13(15)20-11-5-3-4-10(8-11)9-21(18,19)12-6-1-2-7-16(12)17/h1-8,13H,9H2