2-[5-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]pentyl]isoindole-1,3-dione

Systemtic Name: 2-[5-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]pentyl]isoindole-1,3-dione Openeye Name: 2-[5-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]pentyl]isoindoline-1,3-dione CAS Name: 2-[5-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]pentyl]isoindole-1,3-dione IUPAC Name: 2-[5-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]pentyl]isoindole-1,3-dione Traditional Name: 2-[5-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]pentyl]isoindoline-1,3-quinone Formula: C21H18N4O5 MolecularWeight: 406.39142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC3=NC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O5/c26-20-16-9-3-4-10-17(16)21(27)24(20)12-5-1-2-11-18-22-19(23-30-18)14-7-6-8-15(13-14)25(28)29/h3-4,6-10,13H,1-2,5,11-12H2