5-[1-[3,4-bis[bis(fluoranyl)methoxy]phenyl]-2-(1-oxidanidylpyridin-1-ium-4-yl)ethyl]-2-phenylmethoxy-pyridine

Systemtic Name: 5-[1-[3,4-bis[bis(fluoranyl)methoxy]phenyl]-2-(1-oxidanidylpyridin-1-ium-4-yl)ethyl]-2-phenylmethoxy-pyridine Openeye Name: 2-benzyloxy-5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-(1-oxidopyridin-1-ium-4-yl)ethyl]pyridine CAS Name: 5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-(1-oxido-4-pyridin-1-iumyl)ethyl]-2-phenylmethoxypyridine IUPAC Name: 5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-(1-oxidopyridin-1-ium-4-yl)ethyl]-2-phenylmethoxypyridine Traditional Name: 2-benzoxy-5-[1-[3,4-bis(difluoromethoxy)phenyl]-2-(1-oxidopyridin-1-ium-4-yl)ethyl]pyridine Formula: C27H22F4N2O4 MolecularWeight: 514.468193

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC=C(C=C2)C(CC3=CC=[N+](C=C3)[O-])C4=CC(=C(C=C4)OC(F)F)OC(F)F

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC=C(C=C2)C(CC3=CC=[N+](C=C3)[O-])C4=CC(=C(C=C4)OC(F)F)OC(F)F

InChI

InChI=1S/C27H22F4N2O4/c28-26(29)36-23-8-6-20(15-24(23)37-27(30)31)22(14-18-10-12-33(34)13-11-18)21-7-9-25(32-16-21)35-17-19-4-2-1-3-5-19/h1-13,15-16,22,26-27H,14,17H2