1-ethyl-2-[4-[(4-nitrophenyl)methyl]piperazin-4-ium-1-yl]benzimidazole

Systemtic Name: 1-ethyl-2-[4-[(4-nitrophenyl)methyl]piperazin-4-ium-1-yl]benzimidazole Openeye Name: 1-ethyl-2-[4-[(4-nitrophenyl)methyl]piperazin-4-ium-1-yl]benzimidazole CAS Name: 1-ethyl-2-[4-[(4-nitrophenyl)methyl]-1-piperazin-4-iumyl]benzimidazole IUPAC Name: 1-ethyl-2-[4-[(4-nitrophenyl)methyl]piperazin-4-ium-1-yl]benzimidazole Traditional Name: 1-ethyl-2-[4-(4-nitrobenzyl)piperazin-4-ium-1-yl]benzimidazole Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1N3CC[NH+](CC3)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1N3CC[NH+](CC3)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O2/c1-2-24-19-6-4-3-5-18(19)21-20(24)23-13-11-22(12-14-23)15-16-7-9-17(10-8-16)25(26)27/h3-10H,2,11-15H2,1H3/p+1