sodium 2-[(3Z)-4-oxidanylidene-3-[(5-oxidanylidene-1,3-diphenyl-4H-pyrazol-4-yl)hydrazinylidene]cyclohexa-1,5-dien-1-yl]carbonylbenzoate

Systemtic Name: sodium 2-[(3Z)-4-oxidanylidene-3-[(5-oxidanylidene-1,3-diphenyl-4H-pyrazol-4-yl)hydrazinylidene]cyclohexa-1,5-dien-1-yl]carbonylbenzoate Openeye Name: sodium 2-[(3Z)-4-oxo-3-[(5-oxo-1,3-diphenyl-4H-pyrazol-4-yl)hydrazono]cyclohexa-1,5-diene-1-carbonyl]benzoate CAS Name: sodium 2-[oxo-[(3Z)-4-oxo-3-[(5-oxo-1,3-diphenyl-4H-pyrazol-4-yl)hydrazinylidene]-1-cyclohexa-1,5-dienyl]methyl]benzoate IUPAC Name: sodium 2-[(3Z)-4-oxo-3-[(5-oxo-1,3-diphenyl-4H-pyrazol-4-yl)hydrazinylidene]cyclohexa-1,5-diene-1-carbonyl]benzoate Traditional Name: sodium 2-[(3Z)-4-keto-3-[(5-keto-1,3-diphenyl-2-pyrazolin-4-yl)hydrazono]cyclohexa-1,5-diene-1-carbonyl]benzoate Formula: C29H19N4NaO5 MolecularWeight: 526.47473

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2NN=C3C=C(C=CC3=O)C(=O)C4=CC=CC=C4C(=O)[O-])C5=CC=CC=C5.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C2N/N=C\3/C=C(C=CC3=O)C(=O)C4=CC=CC=C4C(=O)[O-])C5=CC=CC=C5.[Na+]

InChI

InChI=1S/C29H20N4O5.Na/c34-24-16-15-19(27(35)21-13-7-8-14-22(21)29(37)38)17-23(24)30-31-26-25(18-9-3-1-4-10-18)32-33(28(26)36)20-11-5-2-6-12-20;/h1-17,26,31H,(H,37,38);/q;+1/p-1/b30-23-;