1-ethyl-3-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]propyl]benzimidazol-2-one

Systemtic Name: 1-ethyl-3-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]propyl]benzimidazol-2-one Openeye Name: 1-[3-(4-benzylpiperazin-4-ium-1-yl)-3-oxo-propyl]-3-ethyl-benzimidazol-2-one CAS Name: 1-ethyl-3-[3-oxo-3-[4-(phenylmethyl)-1-piperazin-4-iumyl]propyl]-2-benzimidazolone IUPAC Name: 1-[3-(4-benzylpiperazin-4-ium-1-yl)-3-oxopropyl]-3-ethylbenzimidazol-2-one Traditional Name: 1-[3-(4-benzylpiperazin-4-ium-1-yl)-3-keto-propyl]-3-ethyl-benzimidazol-2-one Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2/c1-2-26-20-10-6-7-11-21(20)27(23(26)29)13-12-22(28)25-16-14-24(15-17-25)18-19-8-4-3-5-9-19/h3-11H,2,12-18H2,1H3/p+1