2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[[5-(2-furyl)isoxazol-3-yl]methyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[[5-(2-furanyl)-3-isoxazolyl]methyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[[5-(2-furyl)isoxazol-3-yl]methyl]-5-nitro-isoindoline-1,3-quinone Formula: C16H9N3O6 MolecularWeight: 339.25916

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CC(=NO2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C2=CC(=NO2)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H9N3O6/c20-15-11-4-3-10(19(22)23)7-12(11)16(21)18(15)8-9-6-14(25-17-9)13-2-1-5-24-13/h1-7H,8H2