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

Systemtic Name: (4E)-4-[(3-chlorophenyl)methylidene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one Openeye Name: (4E)-4-[(3-chlorophenyl)methylene]-2-(4-nitrophenyl)-5-propyl-pyrazol-3-one CAS Name: (4E)-4-[(3-chlorophenyl)methylidene]-2-(4-nitrophenyl)-5-propyl-3-pyrazolone IUPAC Name: (4E)-4-[(3-chlorophenyl)methylidene]-2-(4-nitrophenyl)-5-propylpyrazol-3-one Traditional Name: (4E)-4-(3-chlorobenzylidene)-2-(4-nitrophenyl)-5-propyl-2-pyrazolin-3-one Formula: C19H16ClN3O3 MolecularWeight: 369.80164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClN3O3/c1-2-4-18-17(12-13-5-3-6-14(20)11-13)19(24)22(21-18)15-7-9-16(10-8-15)23(25)26/h3,5-12H,2,4H2,1H3/b17-12+