2-[(2,4-dichlorophenyl)-(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile

Systemtic Name: 2-[(2,4-dichlorophenyl)-(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile Openeye Name: 2-[(2,4-dichlorophenyl)-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile CAS Name: 2-[(2,4-dichlorophenyl)-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile IUPAC Name: 2-[(2,4-dichlorophenyl)-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)methyl]propanedinitrile Traditional Name: 2-[(2,4-dichlorophenyl)-(3-keto-5-methyl-2-pyrazolin-4-yl)methyl]malononitrile Formula: C14H10Cl2N4O MolecularWeight: 321.1614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)C1C(C2=C(C=C(C=C2)Cl)Cl)C(C#N)C#N

Isomeric SMILES

CC1=NNC(=O)C1C(C2=C(C=C(C=C2)Cl)Cl)C(C#N)C#N

InChI

InChI=1S/C14H10Cl2N4O/c1-7-12(14(21)20-19-7)13(8(5-17)6-18)10-3-2-9(15)4-11(10)16/h2-4,8,12-13H,1H3,(H,20,21)