5-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[3-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]propyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[3-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]propyl]-3-phenyl-1,2,4-oxadiazole Formula: C21H24ClN4O+ MolecularWeight: 383.89446

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=NC(=NO2)C3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=NC(=NO2)C3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H23ClN4O/c22-18-8-4-9-19(16-18)26-14-12-25(13-15-26)11-5-10-20-23-21(24-27-20)17-6-2-1-3-7-17/h1-4,6-9,16H,5,10-15H2/p+1