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

Systemtic Name: 4-[(4Z)-3-methyl-5-oxidanylidene-4-[[5-(3-oxidanylidene-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-1-yl]benzenesulfonate Openeye Name: 4-[(4Z)-3-methyl-5-oxo-4-[[5-(3-oxo-1H-isobenzofuran-5-yl)-2-furyl]methylene]pyrazol-1-yl]benzenesulfonate CAS Name: 4-[(4Z)-3-methyl-5-oxo-4-[[5-(3-oxo-1H-isobenzofuran-5-yl)-2-furanyl]methylidene]-1-pyrazolyl]benzenesulfonate IUPAC Name: 4-[(4Z)-3-methyl-5-oxo-4-[[5-(3-oxo-1H-2-benzofuran-5-yl)furan-2-yl]methylidene]pyrazol-1-yl]benzenesulfonate Traditional Name: 4-[(4Z)-5-keto-4-[[5-(3-ketophthalan-5-yl)-2-furyl]methylene]-3-methyl-2-pyrazolin-1-yl]besylate Formula: C23H15N2O7S- MolecularWeight: 463.4394

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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)S(=O)(=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)S(=O)(=O)[O-]

InChI

InChI=1S/C23H16N2O7S/c1-13-19(22(26)25(24-13)16-4-7-18(8-5-16)33(28,29)30)11-17-6-9-21(32-17)14-2-3-15-12-31-23(27)20(15)10-14/h2-11H,12H2,1H3,(H,28,29,30)/p-1/b19-11-