N'-methyl-N-[3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-yl]carbamimidate

Systemtic Name: N'-methyl-N-[3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-yl]carbamimidate Openeye Name: N'-methyl-N-[3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-yl]carbamimidate CAS Name: N'-methyl-N-[3-(1-phenylpropan-2-yl)-5-oxadiazol-3-iumyl]carbamimidate IUPAC Name: N'-methyl-N-[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]carbamimidate Traditional Name: N'-methyl-N-[3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-yl]carbamimidate Formula: C13H16N4O2 MolecularWeight: 260.29174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)[N+]2=NOC(=C2)NC(=NC)[O-]

Isomeric SMILES

CC(CC1=CC=CC=C1)[N+]2=NOC(=C2)NC(=NC)[O-]

InChI

InChI=1S/C13H16N4O2/c1-10(8-11-6-4-3-5-7-11)17-9-12(19-16-17)15-13(18)14-2/h3-7,9-10H,8H2,1-2H3,(H-,14,15,16,18)