1-[4,4-bis(4-fluorophenyl)butyl]-4-(4-methoxyphenoxy)pyridin-1-ium

Systemtic Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(4-methoxyphenoxy)pyridin-1-ium Openeye Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(4-methoxyphenoxy)pyridin-1-ium CAS Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(4-methoxyphenoxy)pyridin-1-ium IUPAC Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(4-methoxyphenoxy)pyridin-1-ium Traditional Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(4-methoxyphenoxy)pyridin-1-ium Formula: C28H26F2NO2+ MolecularWeight: 446.508346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=CC=[N+](C=C2)CCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)OC2=CC=[N+](C=C2)CCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H26F2NO2/c1-32-25-12-14-26(15-13-25)33-27-16-19-31(20-17-27)18-2-3-28(21-4-8-23(29)9-5-21)22-6-10-24(30)11-7-22/h4-17,19-20,28H,2-3,18H2,1H3/q+1