3-[(4-fluoranyl-3-nitro-phenyl)amino]-6,7-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-[(4-fluoranyl-3-nitro-phenyl)amino]-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-(4-fluoro-3-nitro-anilino)-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-(4-fluoro-3-nitroanilino)-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-(4-fluoro-3-nitroanilino)-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-(4-fluoro-3-nitro-anilino)-6,7-dimethoxy-phthalide Formula: C16H13FN2O6 MolecularWeight: 348.282623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])OC

InChI

InChI=1S/C16H13FN2O6/c1-23-12-6-4-9-13(14(12)24-2)16(20)25-15(9)18-8-3-5-10(17)11(7-8)19(21)22/h3-7,15,18H,1-2H3