disodium (4E)-4-[(4-methylphenyl)hydrazinylidene]-5-oxidanylidene-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: disodium (4E)-4-[(4-methylphenyl)hydrazinylidene]-5-oxidanylidene-1-phenyl-pyrazole-3-carboxylate Openeye Name: disodium (4E)-5-oxo-1-phenyl-4-(p-tolylhydrazono)pyrazole-3-carboxylate CAS Name: disodium (4E)-4-[(4-methylphenyl)hydrazinylidene]-5-oxo-1-phenyl-3-pyrazolecarboxylate IUPAC Name: disodium (4E)-4-[(4-methylphenyl)hydrazinylidene]-5-oxo-1-phenylpyrazole-3-carboxylate Traditional Name: disodium (4E)-5-keto-1-phenyl-4-(p-tolylhydrazono)-2-pyrazoline-3-carboxylate Formula: C17H12N4Na2O3 MolecularWeight: 366.28172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NN=C2C(=NN(C2=O)C3=CC=[C-]C=C3)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)N/N=C/2\C(=NN(C2=O)C3=CC=[C-]C=C3)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C17H13N4O3.2Na/c1-11-7-9-12(10-8-11)18-19-14-15(17(23)24)20-21(16(14)22)13-5-3-2-4-6-13;;/h3-10,18H,1H3,(H,23,24);;/q-1;2*+1/p-1/b19-14+;;