5-[[4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 5-[[4-(m-tolyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 5-[[4-(3-methylphenyl)-1-piperazin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 5-[[4-(3-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 5-[[4-(m-tolyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C14H19N4O+ MolecularWeight: 259.32686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CC3=NC=NO3

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CC3=NC=NO3

InChI

InChI=1S/C14H18N4O/c1-12-3-2-4-13(9-12)18-7-5-17(6-8-18)10-14-15-11-16-19-14/h2-4,9,11H,5-8,10H2,1H3/p+1