(4E)-4-[2-(2,4-dinitrophenyl)-5-methyl-1H-pyrazol-3-ylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[2-(2,4-dinitrophenyl)-5-methyl-1H-pyrazol-3-ylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[2-(2,4-dinitrophenyl)-5-methyl-1H-pyrazol-3-ylidene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[2-(2,4-dinitrophenyl)-5-methyl-1H-pyrazol-3-ylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[2-(2,4-dinitrophenyl)-5-methyl-1H-pyrazol-3-ylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[2-(2,4-dinitrophenyl)-5-methyl-3-pyrazolin-3-ylidene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C20H16N6O5 MolecularWeight: 420.37824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=NN(C2=O)C3=CC=CC=C3)C)N(N1)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C/C(=C\2/C(=NN(C2=O)C3=CC=CC=C3)C)/N(N1)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H16N6O5/c1-12-10-18(19-13(2)22-23(20(19)27)14-6-4-3-5-7-14)24(21-12)16-9-8-15(25(28)29)11-17(16)26(30)31/h3-11,21H,1-2H3/b19-18+