(4E)-2-(4-ethylphenyl)-5-methyl-4-[[5-(3-oxidanylidene-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-3-one

Systemtic Name: (4E)-2-(4-ethylphenyl)-5-methyl-4-[[5-(3-oxidanylidene-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-3-one Openeye Name: (4E)-2-(4-ethylphenyl)-5-methyl-4-[[5-(3-oxo-1H-isobenzofuran-5-yl)-2-furyl]methylene]pyrazol-3-one CAS Name: (4E)-2-(4-ethylphenyl)-5-methyl-4-[[5-(3-oxo-1H-isobenzofuran-5-yl)-2-furanyl]methylidene]-3-pyrazolone IUPAC Name: (4E)-2-(4-ethylphenyl)-5-methyl-4-[[5-(3-oxo-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-3-one Traditional Name: (4E)-2-(4-ethylphenyl)-4-[[5-(3-ketophthalan-5-yl)-2-furyl]methylene]-5-methyl-2-pyrazolin-3-one Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC5=C(COC5=O)C=C4)C(=N2)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC=C(O3)C4=CC5=C(COC5=O)C=C4)/C(=N2)C

InChI

InChI=1S/C25H20N2O4/c1-3-16-4-8-19(9-5-16)27-24(28)21(15(2)26-27)13-20-10-11-23(31-20)17-6-7-18-14-30-25(29)22(18)12-17/h4-13H,3,14H2,1-2H3/b21-13+