2-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-1-methyl-benzimidazole

Systemtic Name: 2-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-1-methyl-benzimidazole Openeye Name: 2-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-1-methyl-benzimidazole CAS Name: 2-[[4-(4-fluorophenyl)-1-piperazin-1-iumyl]methyl]-5-methoxy-1-methylbenzimidazole IUPAC Name: 2-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-1-methylbenzimidazole Traditional Name: 2-[[4-(4-fluorophenyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-1-methyl-benzimidazole Formula: C20H24FN4O+ MolecularWeight: 355.429163

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)N=C1C[NH+]3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)N=C1C[NH+]3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H23FN4O/c1-23-19-8-7-17(26-2)13-18(19)22-20(23)14-24-9-11-25(12-10-24)16-5-3-15(21)4-6-16/h3-8,13H,9-12,14H2,1-2H3/p+1