[(2,3-dimethoxyphenyl)-(3-oxidanylidene-1H-2-benzofuran-1-yl)methyl] 4-nitrobenzoate

Systemtic Name: [(2,3-dimethoxyphenyl)-(3-oxidanylidene-1H-2-benzofuran-1-yl)methyl] 4-nitrobenzoate Openeye Name: [(2,3-dimethoxyphenyl)-(3-oxo-1H-isobenzofuran-1-yl)methyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2,3-dimethoxyphenyl)-(3-oxo-1H-isobenzofuran-1-yl)methyl] ester IUPAC Name: [(2,3-dimethoxyphenyl)-(3-oxo-1H-2-benzofuran-1-yl)methyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2,3-dimethoxyphenyl)-phthalidyl-methyl] ester Formula: C24H19NO8 MolecularWeight: 449.40956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(C2C3=CC=CC=C3C(=O)O2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1OC)C(C2C3=CC=CC=C3C(=O)O2)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H19NO8/c1-30-19-9-5-8-18(20(19)31-2)22(21-16-6-3-4-7-17(16)24(27)33-21)32-23(26)14-10-12-15(13-11-14)25(28)29/h3-13,21-22H,1-2H3