4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)butan-1-one

Systemtic Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)butan-1-one Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-4-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]butan-1-one CAS Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methyl-1-piperazin-4-iumyl)-1-butanone IUPAC Name: 4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)butan-1-one Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-4-[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]butan-1-one Formula: C18H25N4O2+ MolecularWeight: 329.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)CCCC(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)CCCC(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C18H24N4O2/c1-14-5-3-6-15(13-14)18-19-16(24-20-18)7-4-8-17(23)22-11-9-21(2)10-12-22/h3,5-6,13H,4,7-12H2,1-2H3/p+1