3-[(3,4-dimethoxyphenyl)methylidene]-6-nitro-2-benzofuran-1-one

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methylidene]-6-nitro-2-benzofuran-1-one Openeye Name: 3-[(3,4-dimethoxyphenyl)methylene]-6-nitro-isobenzofuran-1-one CAS Name: 3-[(3,4-dimethoxyphenyl)methylidene]-6-nitro-1-isobenzofuranone IUPAC Name: 3-[(3,4-dimethoxyphenyl)methylidene]-6-nitro-2-benzofuran-1-one Traditional Name: 6-nitro-3-veratrylidene-phthalide Formula: C17H13NO6 MolecularWeight: 327.28822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C=C2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O2)OC

InChI

InChI=1S/C17H13NO6/c1-22-14-6-3-10(8-16(14)23-2)7-15-12-5-4-11(18(20)21)9-13(12)17(19)24-15/h3-9H,1-2H3