N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methyl-benzimidazol-5-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methyl-benzimidazol-5-yl]-2-phenoxy-ethanamide Openeye Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methyl-benzimidazol-5-yl]-2-phenoxy-acetamide CAS Name: N-[2-[2-[4-(4-fluorophenyl)-1-piperazin-1-iumyl]ethyl]-1-methyl-5-benzimidazolyl]-2-phenoxyacetamide IUPAC Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methylbenzimidazol-5-yl]-2-phenoxyacetamide Traditional Name: N-[2-[2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-1-methyl-benzimidazol-5-yl]-2-phenoxy-acetamide Formula: C28H31FN5O2+ MolecularWeight: 488.576443

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3)N=C1CC[NH+]4CCN(CC4)C5=CC=C(C=C5)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)COC3=CC=CC=C3)N=C1CC[NH+]4CCN(CC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H30FN5O2/c1-32-26-12-9-22(30-28(35)20-36-24-5-3-2-4-6-24)19-25(26)31-27(32)13-14-33-15-17-34(18-16-33)23-10-7-21(29)8-11-23/h2-12,19H,13-18,20H2,1H3,(H,30,35)/p+1