6,7-dimethoxy-3-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 6,7-dimethoxy-3-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: 6,7-dimethoxy-3-[2-(4-nitrophenyl)-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: 6,7-dimethoxy-3-[2-(4-nitrophenyl)-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: 6,7-dimethoxy-3-[2-(4-nitrophenyl)-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-keto-2-(4-nitrophenyl)ethyl]-6,7-dimethoxy-phthalide Formula: C18H15NO7 MolecularWeight: 357.3142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO7/c1-24-14-8-7-12-15(26-18(21)16(12)17(14)25-2)9-13(20)10-3-5-11(6-4-10)19(22)23/h3-8,15H,9H2,1-2H3