ethyl 4-[(4Z)-3-methyl-5-oxidanylidene-4-[[5-(1-oxidanylidene-3H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-1-yl]benzoate

Systemtic Name: ethyl 4-[(4Z)-3-methyl-5-oxidanylidene-4-[[5-(1-oxidanylidene-3H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-1-yl]benzoate Openeye Name: ethyl 4-[(4Z)-3-methyl-5-oxo-4-[[5-(1-oxo-3H-isobenzofuran-5-yl)-2-furyl]methylene]pyrazol-1-yl]benzoate CAS Name: 4-[(4Z)-3-methyl-5-oxo-4-[[5-(1-oxo-3H-isobenzofuran-5-yl)-2-furanyl]methylidene]-1-pyrazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4Z)-3-methyl-5-oxo-4-[[5-(1-oxo-3H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-1-yl]benzoate Traditional Name: 4-[(4Z)-5-keto-4-[[5-(1-ketophthalan-5-yl)-2-furyl]methylene]-3-methyl-2-pyrazolin-1-yl]benzoic acid ethyl ester Formula: C26H20N2O6 MolecularWeight: 456.4468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC5=C(C=C4)C(=O)OC5)C(=N2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC=C(O3)C4=CC5=C(C=C4)C(=O)OC5)/C(=N2)C

InChI

InChI=1S/C26H20N2O6/c1-3-32-25(30)16-4-7-19(8-5-16)28-24(29)22(15(2)27-28)13-20-9-11-23(34-20)17-6-10-21-18(12-17)14-33-26(21)31/h4-13H,3,14H2,1-2H3/b22-13-