sodium; chromium(3+); (4E)-5-methyl-4-[(4-nitro-2-oxidanidyl-phenyl)hydrazinylidene]pyrazol-3-olate

Systemtic Name: sodium; chromium(3+); (4E)-5-methyl-4-[(4-nitro-2-oxidanidyl-phenyl)hydrazinylidene]pyrazol-3-olate Openeye Name: chromic sodium (4E)-5-methyl-4-[(4-nitro-2-oxido-phenyl)hydrazono]pyrazol-3-olate CAS Name: sodium; chromium(3+); (4E)-5-methyl-4-[(4-nitro-2-oxidophenyl)hydrazinylidene]-3-pyrazololate IUPAC Name: sodium; chromium(3+); (4E)-5-methyl-4-[(4-nitro-2-oxidophenyl)hydrazinylidene]pyrazol-3-olate Traditional Name: chromic sodium (4E)-5-methyl-4-[(4-nitro-2-oxido-phenyl)hydrazono]pyrazol-3-olate Formula: C20H14CrN10NaO8 MolecularWeight: 597.37323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C1=NNC2=C(C=C(C=C2)[N+](=O)[O-])[O-])[O-].CC1=NN=C(C1=NNC2=C(C=C(C=C2)[N+](=O)[O-])[O-])[O-].[Na+].[Cr+3]

Isomeric SMILES

CC\1=NN=C(/C1=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[O-])[O-].CC\1=NN=C(/C1=N/NC2=C(C=C(C=C2)[N+](=O)[O-])[O-])[O-].[Na+].[Cr+3]

InChI

InChI=1S/2C10H9N5O4.Cr.Na/c2*1-5-9(10(17)14-11-5)13-12-7-3-2-6(15(18)19)4-8(7)16;;/h2*2-4,12,16H,1H3,(H,13,14,17);;/q;;+3;+1/p-4