5-[(5-nitrofuran-2-yl)methylamino]isoindole-1,3-dione

Systemtic Name: 5-[(5-nitrofuran-2-yl)methylamino]isoindole-1,3-dione Openeye Name: 5-[(5-nitro-2-furyl)methylamino]isoindoline-1,3-dione CAS Name: 5-[(5-nitro-2-furanyl)methylamino]isoindole-1,3-dione IUPAC Name: 5-[(5-nitrofuran-2-yl)methylamino]isoindole-1,3-dione Traditional Name: 5-[(5-nitro-2-furyl)methylamino]isoindoline-1,3-quinone Formula: C13H9N3O5 MolecularWeight: 287.22766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NCC3=CC=C(O3)[N+](=O)[O-])C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C=C1NCC3=CC=C(O3)[N+](=O)[O-])C(=O)NC2=O

InChI

InChI=1S/C13H9N3O5/c17-12-9-3-1-7(5-10(9)13(18)15-12)14-6-8-2-4-11(21-8)16(19)20/h1-5,14H,6H2,(H,15,17,18)