2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]ethanenitrile

Systemtic Name: 2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]ethanenitrile Openeye Name: 2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]acetonitrile CAS Name: 2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]acetonitrile IUPAC Name: 2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]acetonitrile Traditional Name: 2-[3-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]acetonitrile Formula: C11H7Cl2N3 MolecularWeight: 252.09938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=NNC(=C2)CC#N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C2=NNC(=C2)CC#N)Cl)Cl

InChI

InChI=1S/C11H7Cl2N3/c12-9-2-1-7(5-10(9)13)11-6-8(3-4-14)15-16-11/h1-2,5-6H,3H2,(H,15,16)