2-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[1-[(2-chlorophenyl)methyl]-3-phenyl-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[1-[(2-chlorophenyl)methyl]-3-phenylpyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[1-(2-chlorobenzyl)-3-phenyl-pyrazol-4-yl]methylene]malononitrile Formula: C20H13ClN4 MolecularWeight: 344.79702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C#N)CC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C#N)CC3=CC=CC=C3Cl

InChI

InChI=1S/C20H13ClN4/c21-19-9-5-4-8-17(19)13-25-14-18(10-15(11-22)12-23)20(24-25)16-6-2-1-3-7-16/h1-10,14H,13H2