3-[(4Z)-4-[(4-fluorophenyl)methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[(4Z)-4-[(4-fluorophenyl)methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]propanenitrile Openeye Name: 3-[(4Z)-4-[(4-fluorophenyl)methylene]-3-methyl-5-oxo-pyrazol-1-yl]propanenitrile CAS Name: 3-[(4Z)-4-[(4-fluorophenyl)methylidene]-3-methyl-5-oxo-1-pyrazolyl]propanenitrile IUPAC Name: 3-[(4Z)-4-[(4-fluorophenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]propanenitrile Traditional Name: 3-[(4Z)-4-(4-fluorobenzylidene)-5-keto-3-methyl-2-pyrazolin-1-yl]propionitrile Formula: C14H12FN3O MolecularWeight: 257.262983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)F)CCC#N

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)F)CCC#N

InChI

InChI=1S/C14H12FN3O/c1-10-13(9-11-3-5-12(15)6-4-11)14(19)18(17-10)8-2-7-16/h3-6,9H,2,8H2,1H3/b13-9-