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

Systemtic Name: 1-(4-ethoxyphenyl)-3-[3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-yl]urea Openeye Name: 1-(4-ethoxyphenyl)-3-[3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-yl]urea CAS Name: 1-(4-ethoxyphenyl)-3-[3-(1-phenylpropan-2-yl)-5-oxadiazol-3-iumyl]urea IUPAC Name: 1-(4-ethoxyphenyl)-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-phenetyl-urea Formula: C20H23N4O3+ MolecularWeight: 367.42162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=C[N+](=NO2)C(C)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=C[N+](=NO2)C(C)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3/c1-3-26-18-11-9-17(10-12-18)21-20(25)22-19-14-24(23-27-19)15(2)13-16-7-5-4-6-8-16/h4-12,14-15H,3,13H2,1-2H3,(H-,21,22,23,25)/p+1