1-[[2-[bis(fluoranyl)methoxy]-5-chloranyl-phenyl]methyl]-3-methyl-benzimidazol-3-ium

Systemtic Name: 1-[[2-[bis(fluoranyl)methoxy]-5-chloranyl-phenyl]methyl]-3-methyl-benzimidazol-3-ium Openeye Name: 1-[[5-chloro-2-(difluoromethoxy)phenyl]methyl]-3-methyl-benzimidazol-3-ium CAS Name: 1-[[5-chloro-2-(difluoromethoxy)phenyl]methyl]-3-methylbenzimidazol-3-ium IUPAC Name: 1-[[5-chloro-2-(difluoromethoxy)phenyl]methyl]-3-methylbenzimidazol-3-ium Traditional Name: 1-[5-chloro-2-(difluoromethoxy)benzyl]-3-methyl-benzimidazol-3-ium Formula: C16H14ClF2N2O+ MolecularWeight: 323.744966

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C2=CC=CC=C21)CC3=C(C=CC(=C3)Cl)OC(F)F

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)CC3=C(C=CC(=C3)Cl)OC(F)F

InChI

InChI=1S/C16H14ClF2N2O/c1-20-10-21(14-5-3-2-4-13(14)20)9-11-8-12(17)6-7-15(11)22-16(18)19/h2-8,10,16H,9H2,1H3/q+1