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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)CCC2=NC(=NO2)CC3=CC=CC=C3

Isomeric SMILES

CC1=[N+](C=CN1)CCC2=NC(=NO2)CC3=CC=CC=C3

InChI

InChI=1S/C15H16N4O/c1-12-16-8-10-19(12)9-7-15-17-14(18-20-15)11-13-5-3-2-4-6-13/h2-6,8,10H,7,9,11H2,1H3/p+1