3-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 3-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]benzenecarbonitrile Openeye Name: 3-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]benzonitrile CAS Name: 3-[3-methyl-5-(trifluoromethyl)-1-pyrazolyl]benzonitrile IUPAC Name: 3-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]benzonitrile Traditional Name: 3-[3-methyl-5-(trifluoromethyl)pyrazol-1-yl]benzonitrile Formula: C12H8F3N3 MolecularWeight: 251.20723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(F)(F)F)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=NN(C(=C1)C(F)(F)F)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C12H8F3N3/c1-8-5-11(12(13,14)15)18(17-8)10-4-2-3-9(6-10)7-16/h2-6H,1H3