4-[5-chloranyl-4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[5-chloranyl-4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenecarbonitrile Openeye Name: 4-[5-chloro-4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]benzonitrile CAS Name: 4-[5-chloro-4-(hydroxymethyl)-3-(trifluoromethyl)-1-pyrazolyl]benzonitrile IUPAC Name: 4-[5-chloro-4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]benzonitrile Traditional Name: 4-[5-chloro-4-methylol-3-(trifluoromethyl)pyrazol-1-yl]benzonitrile Formula: C12H7ClF3N3O MolecularWeight: 301.65169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7ClF3N3O/c13-11-9(6-20)10(12(14,15)16)18-19(11)8-3-1-7(5-17)2-4-8/h1-4,20H,6H2