2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 5-nitro-2-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]-5-nitroisoindole-1,3-dione Traditional Name: 5-nitro-2-[[5-(p-tolyl)-1,3,4-oxadiazol-2-yl]methyl]isoindoline-1,3-quinone Formula: C18H12N4O5 MolecularWeight: 364.31168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(O2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(O2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O5/c1-10-2-4-11(5-3-10)16-20-19-15(27-16)9-21-17(23)13-7-6-12(22(25)26)8-14(13)18(21)24/h2-8H,9H2,1H3