5-[bis(chloranyl)methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-[bis(chloranyl)methyl]-3-methyl-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-(dichloromethyl)-3-methyl-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-(dichloromethyl)-3-methyl-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-(dichloromethyl)-3-methyl-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-(dichloromethyl)-3-methyl-1-phenyl-pyrazole-4-carbonitrile Formula: C12H9Cl2N3 MolecularWeight: 266.12596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)C(Cl)Cl)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C#N)C(Cl)Cl)C2=CC=CC=C2

InChI

InChI=1S/C12H9Cl2N3/c1-8-10(7-15)11(12(13)14)17(16-8)9-5-3-2-4-6-9/h2-6,12H,1H3