N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C18H22N6O2+2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C18H20N6O2/c25-17(20-13-4-5-14-15(11-13)22-18(26)21-14)12-23-7-9-24(10-8-23)16-3-1-2-6-19-16/h1-6,11H,7-10,12H2,(H,20,25)(H2,21,22,26)/p+2