4-[(2E)-2-[1-(4-nitrophenyl)-5-oxidanylidene-3-phenyl-pyrazol-4-ylidene]hydrazinyl]benzoate

Systemtic Name: 4-[(2E)-2-[1-(4-nitrophenyl)-5-oxidanylidene-3-phenyl-pyrazol-4-ylidene]hydrazinyl]benzoate Openeye Name: 4-[(2E)-2-[1-(4-nitrophenyl)-5-oxo-3-phenyl-pyrazol-4-ylidene]hydrazino]benzoate CAS Name: 4-[(2E)-2-[1-(4-nitrophenyl)-5-oxo-3-phenyl-4-pyrazolylidene]hydrazinyl]benzoate IUPAC Name: 4-[(2E)-2-[1-(4-nitrophenyl)-5-oxo-3-phenylpyrazol-4-ylidene]hydrazinyl]benzoate Traditional Name: 4-[(N'E)-N'-[5-keto-1-(4-nitrophenyl)-3-phenyl-2-pyrazolin-4-ylidene]hydrazino]benzoate Formula: C22H14N5O5- MolecularWeight: 428.37706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C2=NNC3=CC=C(C=C3)C(=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C\2=NN(C(=O)/C2=N/NC3=CC=C(C=C3)C(=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N5O5/c28-21-20(24-23-16-8-6-15(7-9-16)22(29)30)19(14-4-2-1-3-5-14)25-26(21)17-10-12-18(13-11-17)27(31)32/h1-13,23H,(H,29,30)/p-1/b24-20+