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

Systemtic Name: 2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-nitro-isoindoline-1,3-quinone Formula: C19H14N4O5 MolecularWeight: 378.33826

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N4O5/c1-2-11-6-8-12(9-7-11)17-20-15(28-21-17)10-22-18(24)13-4-3-5-14(23(26)27)16(13)19(22)25/h3-9H,2,10H2,1H3