4-[(4E)-3-methyl-4-[[4-(2-oxidanidyl-2-oxidanylidene-ethoxy)phenyl]methylidene]-5-oxidanylidene-pyrazol-1-yl]benzoate

Systemtic Name: 4-[(4E)-3-methyl-4-[[4-(2-oxidanidyl-2-oxidanylidene-ethoxy)phenyl]methylidene]-5-oxidanylidene-pyrazol-1-yl]benzoate Openeye Name: 4-[(4E)-3-methyl-4-[[4-(2-oxido-2-oxo-ethoxy)phenyl]methylene]-5-oxo-pyrazol-1-yl]benzoate CAS Name: 4-[(4E)-3-methyl-4-[[4-(2-oxido-2-oxoethoxy)phenyl]methylidene]-5-oxo-1-pyrazolyl]benzoate IUPAC Name: 4-[(4E)-3-methyl-4-[[4-(2-oxido-2-oxoethoxy)phenyl]methylidene]-5-oxopyrazol-1-yl]benzoate Traditional Name: 4-[(4E)-5-keto-4-[4-(2-keto-2-oxido-ethoxy)benzylidene]-3-methyl-2-pyrazolin-1-yl]benzoate Formula: C20H14N2O6-2 MolecularWeight: 378.33496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)OCC(=O)[O-])C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(C=C2)OCC(=O)[O-])C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C20H16N2O6/c1-12-17(10-13-2-8-16(9-3-13)28-11-18(23)24)19(25)22(21-12)15-6-4-14(5-7-15)20(26)27/h2-10H,11H2,1H3,(H,23,24)(H,26,27)/p-2/b17-10+