methyl 3-(4-methylphenyl)-5-(4-nitrophenyl)-2-phenyl-1,2,4-oxadiazole-5-carboxylate

Systemtic Name: methyl 3-(4-methylphenyl)-5-(4-nitrophenyl)-2-phenyl-1,2,4-oxadiazole-5-carboxylate Openeye Name: methyl 5-(4-nitrophenyl)-2-phenyl-3-(p-tolyl)-1,2,4-oxadiazole-5-carboxylate CAS Name: 3-(4-methylphenyl)-5-(4-nitrophenyl)-2-phenyl-1,2,4-oxadiazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(4-methylphenyl)-5-(4-nitrophenyl)-2-phenyl-1,2,4-oxadiazole-5-carboxylate Traditional Name: 5-(4-nitrophenyl)-2-phenyl-3-(p-tolyl)-1,2,4-oxadiazole-5-carboxylic acid methyl ester Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(ON2C3=CC=CC=C3)(C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(ON2C3=CC=CC=C3)(C4=CC=C(C=C4)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C23H19N3O5/c1-16-8-10-17(11-9-16)21-24-23(22(27)30-2,18-12-14-20(15-13-18)26(28)29)31-25(21)19-6-4-3-5-7-19/h3-15H,1-2H3