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

Systemtic Name: 5-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-3-(2-methylphenyl)-1,2,4-oxadiazole Openeye Name: 5-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-3-(o-tolyl)-1,2,4-oxadiazole CAS Name: 5-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-3-(2-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-3-(2-methylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-3-(o-tolyl)-1,2,4-oxadiazole Formula: C15H17N4O+ MolecularWeight: 269.32168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)CC[N+]3=C(NC=C3)C

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)CC[N+]3=C(NC=C3)C

InChI

InChI=1S/C15H16N4O/c1-11-5-3-4-6-13(11)15-17-14(20-18-15)7-9-19-10-8-16-12(19)2/h3-6,8,10H,7,9H2,1-2H3/p+1