2-[1-(4-chlorophenyl)-3-phenyl-pyrazol-4-yl]ethanenitrile

Systemtic Name: 2-[1-(4-chlorophenyl)-3-phenyl-pyrazol-4-yl]ethanenitrile Openeye Name: 2-[1-(4-chlorophenyl)-3-phenyl-pyrazol-4-yl]acetonitrile CAS Name: 2-[1-(4-chlorophenyl)-3-phenyl-4-pyrazolyl]acetonitrile IUPAC Name: 2-[1-(4-chlorophenyl)-3-phenylpyrazol-4-yl]acetonitrile Traditional Name: 2-[1-(4-chlorophenyl)-3-phenyl-pyrazol-4-yl]acetonitrile Formula: C17H12ClN3 MolecularWeight: 293.75028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CC#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CC#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H12ClN3/c18-15-6-8-16(9-7-15)21-12-14(10-11-19)17(20-21)13-4-2-1-3-5-13/h1-9,12H,10H2