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

Systemtic Name: 4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)butan-1-one Openeye Name: 4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)butan-1-one CAS Name: 4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methyl-1-piperazin-4-iumyl)-1-butanone IUPAC Name: 4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)butan-1-one Traditional Name: 4-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-4-ium-1-yl)butan-1-one Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CCCC2=NC(=NO2)C3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CCCC2=NC(=NO2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C18H24N4O3/c1-21-9-11-22(12-10-21)17(23)8-4-7-16-19-18(20-25-16)14-5-3-6-15(13-14)24-2/h3,5-6,13H,4,7-12H2,1-2H3/p+1