1-ethyl-3-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-2-one

Systemtic Name: 1-ethyl-3-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-2-one Openeye Name: 1-ethyl-3-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-2-one CAS Name: 1-ethyl-3-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-2-benzimidazolone IUPAC Name: 1-ethyl-3-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]benzimidazol-2-one Traditional Name: 1-ethyl-3-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]benzimidazol-2-one Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

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