2-[(4-chloranyl-3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-yl)methoxymethylidene]propanedinitrile

Systemtic Name: 2-[(4-chloranyl-3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-yl)methoxymethylidene]propanedinitrile Openeye Name: 2-[(4-chloro-3-methyl-5-oxo-1-phenyl-pyrazol-4-yl)methoxymethylene]propanedinitrile CAS Name: 2-[(4-chloro-3-methyl-5-oxo-1-phenyl-4-pyrazolyl)methoxymethylidene]propanedinitrile IUPAC Name: 2-[(4-chloro-3-methyl-5-oxo-1-phenylpyrazol-4-yl)methoxymethylidene]propanedinitrile Traditional Name: 2-[(4-chloro-5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl)methoxymethylene]malononitrile Formula: C15H11ClN4O2 MolecularWeight: 314.72644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1(COC=C(C#N)C#N)Cl)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1(COC=C(C#N)C#N)Cl)C2=CC=CC=C2

InChI

InChI=1S/C15H11ClN4O2/c1-11-15(16,10-22-9-12(7-17)8-18)14(21)20(19-11)13-5-3-2-4-6-13/h2-6,9H,10H2,1H3