4-[(4E)-4-[1-(4-carboxyphenyl)-3-ethanoyl-5-oxidanylidene-pyrazol-4-ylidene]-3-ethanoyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[(4E)-4-[1-(4-carboxyphenyl)-3-ethanoyl-5-oxidanylidene-pyrazol-4-ylidene]-3-ethanoyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4E)-3-acetyl-4-[3-acetyl-1-(4-carboxyphenyl)-5-oxo-pyrazol-4-ylidene]-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: 4-[(4E)-3-acetyl-4-[3-acetyl-1-(4-carboxyphenyl)-5-oxo-4-pyrazolylidene]-5-oxo-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4E)-3-acetyl-4-[3-acetyl-1-(4-carboxyphenyl)-5-oxopyrazol-4-ylidene]-5-oxopyrazol-1-yl]benzoic acid Traditional Name: 4-[(4E)-3-acetyl-4-[3-acetyl-1-(4-carboxyphenyl)-5-keto-2-pyrazolin-4-ylidene]-5-keto-2-pyrazolin-1-yl]benzoic acid Formula: C24H16N4O8 MolecularWeight: 488.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=O)C1=C2C(=NN(C2=O)C3=CC=C(C=C3)C(=O)O)C(=O)C)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC(=O)C\1=NN(C(=O)/C1=C/2\C(=NN(C2=O)C3=CC=C(C=C3)C(=O)O)C(=O)C)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H16N4O8/c1-11(29)19-17(21(31)27(25-19)15-7-3-13(4-8-15)23(33)34)18-20(12(2)30)26-28(22(18)32)16-9-5-14(6-10-16)24(35)36/h3-10H,1-2H3,(H,33,34)(H,35,36)/b18-17+