2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]-1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]-1-(4-pyridin-1-ium-2-ylpiperazino)ethanone Formula: C25H24N5O3+ MolecularWeight: 442.48976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)COC3=CC=C(C=C3)C4=NC(=NO4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)COC3=CC=C(C=C3)C4=NC(=NO4)C5=CC=CC=C5

InChI

InChI=1S/C25H23N5O3/c31-23(30-16-14-29(15-17-30)22-8-4-5-13-26-22)18-32-21-11-9-20(10-12-21)25-27-24(28-33-25)19-6-2-1-3-7-19/h1-13H,14-18H2/p+1