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

Systemtic Name: 4-[(4E)-3-methyl-5-oxidanylidene-4-[[5-(3-oxidanylidene-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4E)-3-methyl-5-oxo-4-[[5-(3-oxo-1H-isobenzofuran-5-yl)-2-furyl]methylene]pyrazol-1-yl]benzoic acid CAS Name: 4-[(4E)-3-methyl-5-oxo-4-[[5-(3-oxo-1H-isobenzofuran-5-yl)-2-furanyl]methylidene]-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4E)-3-methyl-5-oxo-4-[[5-(3-oxo-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-1-yl]benzoic acid Traditional Name: 4-[(4E)-5-keto-4-[[5-(3-ketophthalan-5-yl)-2-furyl]methylene]-3-methyl-2-pyrazolin-1-yl]benzoic acid Formula: C24H16N2O6 MolecularWeight: 428.39364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC4=C(COC4=O)C=C3)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(O2)C3=CC4=C(COC4=O)C=C3)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C24H16N2O6/c1-13-19(22(27)26(25-13)17-6-4-14(5-7-17)23(28)29)11-18-8-9-21(32-18)15-2-3-16-12-31-24(30)20(16)10-15/h2-11H,12H2,1H3,(H,28,29)/b19-11+