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

Systemtic Name: 2-[4-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazol-3-yl]ethanenitrile Openeye Name: 2-[4-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazol-3-yl]acetonitrile CAS Name: 2-[4-phenyl-1-[3-(trifluoromethyl)phenyl]-3-pyrazolyl]acetonitrile IUPAC Name: 2-[4-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazol-3-yl]acetonitrile Traditional Name: 2-[4-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazol-3-yl]acetonitrile Formula: C18H12F3N3 MolecularWeight: 327.30319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(N=C2CC#N)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(N=C2CC#N)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H12F3N3/c19-18(20,21)14-7-4-8-15(11-14)24-12-16(17(23-24)9-10-22)13-5-2-1-3-6-13/h1-8,11-12H,9H2