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

Systemtic Name: 3-methyl-5-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-1,2,4-oxadiazole Openeye Name: 3-methyl-5-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-1,2,4-oxadiazole CAS Name: 3-methyl-5-[2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-1,2,4-oxadiazole IUPAC Name: 3-methyl-5-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-1,2,4-oxadiazole Traditional Name: 3-methyl-5-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-1,2,4-oxadiazole Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCC3=NC(=NO3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCC3=NC(=NO3)C

InChI

InChI=1S/C16H22N4O/c1-13-4-3-5-15(12-13)20-10-8-19(9-11-20)7-6-16-17-14(2)18-21-16/h3-5,12H,6-11H2,1-2H3/p+1