2-[2,6-bis(fluoranyl)phenyl]-1-(cyclopentylmethyl)-3-methyl-benzimidazol-3-ium

Systemtic Name: 2-[2,6-bis(fluoranyl)phenyl]-1-(cyclopentylmethyl)-3-methyl-benzimidazol-3-ium Openeye Name: 1-(cyclopentylmethyl)-2-(2,6-difluorophenyl)-3-methyl-benzimidazol-3-ium CAS Name: 1-(cyclopentylmethyl)-2-(2,6-difluorophenyl)-3-methylbenzimidazol-3-ium IUPAC Name: 1-(cyclopentylmethyl)-2-(2,6-difluorophenyl)-3-methylbenzimidazol-3-ium Traditional Name: 1-(cyclopentylmethyl)-2-(2,6-difluorophenyl)-3-methyl-benzimidazol-3-ium Formula: C20H16F2N2+ MolecularWeight: 322.351246

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(C2=CC=CC=C21)C[C]3[CH][CH][CH][CH]3)C4=C(C=CC=C4F)F

Isomeric SMILES

C[N+]1=C(N(C2=CC=CC=C21)C[C]3[CH][CH][CH][CH]3)C4=C(C=CC=C4F)F

InChI

InChI=1S/C20H16F2N2/c1-23-17-11-4-5-12-18(17)24(13-14-7-2-3-8-14)20(23)19-15(21)9-6-10-16(19)22/h2-12H,13H2,1H3/q+1