2-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]methylene]malononitrile Formula: C16H13ClN4 MolecularWeight: 296.75422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C=C(C#N)C#N

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C=C(C#N)C#N

InChI

InChI=1S/C16H13ClN4/c1-11-15(7-13(8-18)9-19)12(2)21(20-11)10-14-5-3-4-6-16(14)17/h3-7H,10H2,1-2H3