3-(4-methylphenyl)-5-(piperazin-4-ium-1-ylmethyl)-1,2,4-oxadiazole

Systemtic Name: 3-(4-methylphenyl)-5-(piperazin-4-ium-1-ylmethyl)-1,2,4-oxadiazole Openeye Name: 5-(piperazin-4-ium-1-ylmethyl)-3-(p-tolyl)-1,2,4-oxadiazole CAS Name: 3-(4-methylphenyl)-5-(1-piperazin-4-iumylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-(4-methylphenyl)-5-(piperazin-4-ium-1-ylmethyl)-1,2,4-oxadiazole Traditional Name: 5-(piperazin-4-ium-1-ylmethyl)-3-(p-tolyl)-1,2,4-oxadiazole Formula: C14H19N4O+ MolecularWeight: 259.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CC[NH2+]CC3

InChI

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