(4Z)-2-(4-nitrophenyl)-4-[(3-nitrophenyl)methylidene]-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-2-(4-nitrophenyl)-4-[(3-nitrophenyl)methylidene]-5-propyl-pyrazol-3-one Openeye Name: (4Z)-2-(4-nitrophenyl)-4-[(3-nitrophenyl)methylene]-5-propyl-pyrazol-3-one CAS Name: (4Z)-2-(4-nitrophenyl)-4-[(3-nitrophenyl)methylidene]-5-propyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-nitrophenyl)-4-[(3-nitrophenyl)methylidene]-5-propylpyrazol-3-one Traditional Name: (4Z)-4-(3-nitrobenzylidene)-2-(4-nitrophenyl)-5-propyl-2-pyrazolin-3-one Formula: C19H16N4O5 MolecularWeight: 380.35414

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CC2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C\C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O5/c1-2-4-18-17(12-13-5-3-6-16(11-13)23(27)28)19(24)21(20-18)14-7-9-15(10-8-14)22(25)26/h3,5-12H,2,4H2,1H3/b17-12-