(2E)-2-[(5-nitrofuran-2-yl)methylidene]-6,7-bis(oxidanyl)-1-benzofuran-3-one

Systemtic Name: (2E)-2-[(5-nitrofuran-2-yl)methylidene]-6,7-bis(oxidanyl)-1-benzofuran-3-one Openeye Name: (2E)-6,7-dihydroxy-2-[(5-nitro-2-furyl)methylene]benzofuran-3-one CAS Name: (2E)-6,7-dihydroxy-2-[(5-nitro-2-furanyl)methylidene]-3-benzofuranone IUPAC Name: (2E)-6,7-dihydroxy-2-[(5-nitrofuran-2-yl)methylidene]-1-benzofuran-3-one Traditional Name: (2E)-6,7-dihydroxy-2-[(5-nitro-2-furyl)methylene]coumaran-3-one Formula: C13H7NO7 MolecularWeight: 289.19718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1C(=O)C(=CC3=CC=C(O3)[N+](=O)[O-])O2)O)O

Isomeric SMILES

C1=CC(=C(C2=C1C(=O)/C(=C\C3=CC=C(O3)[N+](=O)[O-])/O2)O)O

InChI

InChI=1S/C13H7NO7/c15-8-3-2-7-11(16)9(21-13(7)12(8)17)5-6-1-4-10(20-6)14(18)19/h1-5,15,17H/b9-5+