5-[5-(3,4-dimethoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-4,7-dimethoxy-1-benzofuran-6-one

Systemtic Name: 5-[5-(3,4-dimethoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-4,7-dimethoxy-1-benzofuran-6-one Openeye Name: 5-[5-(3,4-dimethoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-4,7-dimethoxy-benzofuran-6-one CAS Name: 5-[5-(3,4-dimethoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-4,7-dimethoxy-6-benzofuranone IUPAC Name: 5-[5-(3,4-dimethoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-4,7-dimethoxy-1-benzofuran-6-one Traditional Name: 5-[5-(3,4-dimethoxyphenyl)-3-pyrazolin-3-ylidene]-4,7-dimethoxy-benzofuran-6-one Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=C3C(=C4C=COC4=C(C3=O)OC)OC)NN2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C3C(=C4C=COC4=C(C3=O)OC)OC)NN2)OC

InChI

InChI=1S/C21H20N2O6/c1-25-15-6-5-11(9-16(15)26-2)13-10-14(23-22-13)17-18(24)21(28-4)20-12(7-8-29-20)19(17)27-3/h5-10,22-23H,1-4H3