4-[3-(trifluoromethyl)pyrazol-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[3-(trifluoromethyl)pyrazol-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[3-(trifluoromethyl)pyrazole-1-carbonyl]benzonitrile CAS Name: 4-[oxo-[3-(trifluoromethyl)-1-pyrazolyl]methyl]benzonitrile IUPAC Name: 4-[3-(trifluoromethyl)pyrazole-1-carbonyl]benzonitrile Traditional Name: 4-[3-(trifluoromethyl)pyrazole-1-carbonyl]benzonitrile Formula: C12H6F3N3O MolecularWeight: 265.19075

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)N2C=CC(=N2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)N2C=CC(=N2)C(F)(F)F

InChI

InChI=1S/C12H6F3N3O/c13-12(14,15)10-5-6-18(17-10)11(19)9-3-1-8(7-16)2-4-9/h1-6H