1-(4-methylphenyl)-3-[3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-yl]urea

Systemtic Name: 1-(4-methylphenyl)-3-[3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-yl]urea Openeye Name: 1-[3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-yl]-3-(p-tolyl)urea CAS Name: 1-(4-methylphenyl)-3-[3-(1-phenylpropan-2-yl)-5-oxadiazol-3-iumyl]urea IUPAC Name: 1-(4-methylphenyl)-3-[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]urea Traditional Name: 1-[3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-yl]-3-(p-tolyl)urea Formula: C19H21N4O2+ MolecularWeight: 337.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=C[N+](=NO2)C(C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=C[N+](=NO2)C(C)CC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2/c1-14-8-10-17(11-9-14)20-19(24)21-18-13-23(22-25-18)15(2)12-16-6-4-3-5-7-16/h3-11,13,15H,12H2,1-2H3,(H-,20,21,22,24)/p+1