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

Systemtic Name: 3-(4-chlorophenyl)-5-(piperazin-4-ium-1-ylmethyl)-1,2,4-oxadiazole Openeye Name: 3-(4-chlorophenyl)-5-(piperazin-4-ium-1-ylmethyl)-1,2,4-oxadiazole CAS Name: 3-(4-chlorophenyl)-5-(1-piperazin-4-iumylmethyl)-1,2,4-oxadiazole IUPAC Name: 3-(4-chlorophenyl)-5-(piperazin-4-ium-1-ylmethyl)-1,2,4-oxadiazole Traditional Name: 3-(4-chlorophenyl)-5-(piperazin-4-ium-1-ylmethyl)-1,2,4-oxadiazole Formula: C13H16ClN4O+ MolecularWeight: 279.74534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=NC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=NC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C13H15ClN4O/c14-11-3-1-10(2-4-11)13-16-12(19-17-13)9-18-7-5-15-6-8-18/h1-4,15H,5-9H2/p+1