N-(2-ethenyl-4-methyl-3-phenyl-5H-1,2,4-oxadiazol-4-ium-5-yl)-N-phenyl-ethanamide; methyl sulfate

Systemtic Name: N-(2-ethenyl-4-methyl-3-phenyl-5H-1,2,4-oxadiazol-4-ium-5-yl)-N-phenyl-ethanamide; methyl sulfate Openeye Name: N-(4-methyl-3-phenyl-2-vinyl-5H-1,2,4-oxadiazol-4-ium-5-yl)-N-phenyl-acetamide; methyl sulfate CAS Name: N-(2-ethenyl-4-methyl-3-phenyl-5H-1,2,4-oxadiazol-4-ium-5-yl)-N-phenylacetamide; methyl sulfate IUPAC Name: N-(2-ethenyl-4-methyl-3-phenyl-5H-1,2,4-oxadiazol-4-ium-5-yl)-N-phenylacetamide; methyl sulfate Traditional Name: N-(4-methyl-3-phenyl-2-vinyl-5H-1,2,4-oxadiazol-4-ium-5-yl)-N-phenyl-acetamide; methyl sulfate Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1[N+](=C(N(O1)C=C)C2=CC=CC=C2)C)C3=CC=CC=C3.COS(=O)(=O)[O-]

Isomeric SMILES

CC(=O)N(C1[N+](=C(N(O1)C=C)C2=CC=CC=C2)C)C3=CC=CC=C3.COS(=O)(=O)[O-]

InChI

InChI=1S/C19H20N3O2.CH4O4S/c1-4-21-18(16-11-7-5-8-12-16)20(3)19(24-21)22(15(2)23)17-13-9-6-10-14-17;1-5-6(2,3)4/h4-14,19H,1H2,2-3H3;1H3,(H,2,3,4)/q+1;/p-1