5,6-dimethoxy-7-nitro-3H-2-benzofuran-1-one

Systemtic Name: 5,6-dimethoxy-7-nitro-3H-2-benzofuran-1-one Openeye Name: 5,6-dimethoxy-7-nitro-3H-isobenzofuran-1-one CAS Name: 5,6-dimethoxy-7-nitro-3H-isobenzofuran-1-one IUPAC Name: 5,6-dimethoxy-7-nitro-3H-2-benzofuran-1-one Traditional Name: 5,6-dimethoxy-7-nitro-phthalide Formula: C10H9NO6 MolecularWeight: 239.18156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)COC2=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)COC2=O)[N+](=O)[O-])OC

InChI

InChI=1S/C10H9NO6/c1-15-6-3-5-4-17-10(12)7(5)8(11(13)14)9(6)16-2/h3H,4H2,1-2H3