5-[[4-(4-ethylpiperazin-1-yl)piperidin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(4-ethylpiperazin-1-yl)piperidin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[[4-(4-ethylpiperazin-1-yl)piperidin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[[4-(4-ethyl-1-piperazinyl)-1-piperidin-1-iumyl]methyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(4-ethylpiperazin-1-yl)piperidin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[[4-(4-ethylpiperazino)piperidin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole Formula: C20H30N5O+ MolecularWeight: 356.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C20H29N5O/c1-2-23-12-14-25(15-13-23)18-8-10-24(11-9-18)16-19-21-20(22-26-19)17-6-4-3-5-7-17/h3-7,18H,2,8-16H2,1H3/p+1