6,7-dimethoxy-3-nitro-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 6,7-dimethoxy-3-nitro-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 4-hydroxy-6,7-dimethoxy-3-nitro-naphthalene-1,2-dione CAS Name: 4-hydroxy-6,7-dimethoxy-3-nitronaphthalene-1,2-dione IUPAC Name: 4-hydroxy-6,7-dimethoxy-3-nitronaphthalene-1,2-dione Traditional Name: 4-hydroxy-6,7-dimethoxy-3-nitro-1,2-naphthoquinone Formula: C12H9NO7 MolecularWeight: 279.20236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C(=O)C2=O)[N+](=O)[O-])O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C(=O)C2=O)[N+](=O)[O-])O)OC

InChI

InChI=1S/C12H9NO7/c1-19-7-3-5-6(4-8(7)20-2)11(15)12(16)9(10(5)14)13(17)18/h3-4,14H,1-2H3