1-[4,4-bis(4-fluorophenyl)butyl]-4-(2-chloranylphenoxy)pyridin-1-ium

Systemtic Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(2-chloranylphenoxy)pyridin-1-ium Openeye Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(2-chlorophenoxy)pyridin-1-ium CAS Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(2-chlorophenoxy)pyridin-1-ium IUPAC Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(2-chlorophenoxy)pyridin-1-ium Traditional Name: 1-[4,4-bis(4-fluorophenyl)butyl]-4-(2-chlorophenoxy)pyridin-1-ium Formula: C27H23ClF2NO+ MolecularWeight: 450.927426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H23ClF2NO/c28-26-5-1-2-6-27(26)32-24-15-18-31(19-16-24)17-3-4-25(20-7-11-22(29)12-8-20)21-9-13-23(30)14-10-21/h1-2,5-16,18-19,25H,3-4,17H2/q+1