1-cyclopropyl-5-fluoranyl-6-(4-methylpiperazin-1-yl)-1-phenylmethoxy-benzimidazol-1-ium

Systemtic Name: 1-cyclopropyl-5-fluoranyl-6-(4-methylpiperazin-1-yl)-1-phenylmethoxy-benzimidazol-1-ium Openeye Name: 1-benzyloxy-1-cyclopropyl-5-fluoro-6-(4-methylpiperazin-1-yl)benzimidazol-1-ium CAS Name: 1-cyclopropyl-5-fluoro-6-(4-methyl-1-piperazinyl)-1-phenylmethoxybenzimidazol-1-ium IUPAC Name: 1-cyclopropyl-5-fluoro-6-(4-methylpiperazin-1-yl)-1-phenylmethoxybenzimidazol-1-ium Traditional Name: 1-benzoxy-1-cyclopropyl-5-fluoro-6-(4-methylpiperazino)benzimidazol-1-ium Formula: C22H26FN4O+ MolecularWeight: 381.466443

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)[N+](C=N3)(C4CC4)OCC5=CC=CC=C5)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)[N+](C=N3)(C4CC4)OCC5=CC=CC=C5)F

InChI

InChI=1S/C22H26FN4O/c1-25-9-11-26(12-10-25)21-14-22-20(13-19(21)23)24-16-27(22,18-7-8-18)28-15-17-5-3-2-4-6-17/h2-6,13-14,16,18H,7-12,15H2,1H3/q+1