1-(4-fluorophenyl)-5-nitro-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole

Systemtic Name: 1-(4-fluorophenyl)-5-nitro-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole Openeye Name: 1-(4-fluorophenyl)-5-nitro-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole CAS Name: 1-(4-fluorophenyl)-5-nitro-2-(1-pyrrolidin-1-iumylmethyl)benzimidazole IUPAC Name: 1-(4-fluorophenyl)-5-nitro-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole Traditional Name: 1-(4-fluorophenyl)-5-nitro-2-(pyrrolidin-1-ium-1-ylmethyl)benzimidazole Formula: C18H18FN4O2+ MolecularWeight: 341.359523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NC3=C(N2C4=CC=C(C=C4)F)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC[NH+](C1)CC2=NC3=C(N2C4=CC=C(C=C4)F)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17FN4O2/c19-13-3-5-14(6-4-13)22-17-8-7-15(23(24)25)11-16(17)20-18(22)12-21-9-1-2-10-21/h3-8,11H,1-2,9-10,12H2/p+1