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

Systemtic Name: 2-[[5-chloranyl-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[5-chloro-1-(2,5-dimethylphenyl)-3-methylpyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[5-chloro-1-(2,5-dimethylphenyl)-3-methyl-pyrazol-4-yl]methylene]malononitrile Formula: C16H13ClN4 MolecularWeight: 296.75422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=C(C(=N2)C)C=C(C#N)C#N)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=C(C(=N2)C)C=C(C#N)C#N)Cl

InChI

InChI=1S/C16H13ClN4/c1-10-4-5-11(2)15(6-10)21-16(17)14(12(3)20-21)7-13(8-18)9-19/h4-7H,1-3H3