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

Systemtic Name: 3-[5-chloranyl-4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenecarbonitrile Openeye Name: 3-[5-chloro-4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]benzonitrile CAS Name: 3-[5-chloro-4-(hydroxymethyl)-3-(trifluoromethyl)-1-pyrazolyl]benzonitrile IUPAC Name: 3-[5-chloro-4-(hydroxymethyl)-3-(trifluoromethyl)pyrazol-1-yl]benzonitrile Traditional Name: 3-[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(=C1)N2C(=C(C(=N2)C(F)(F)F)CO)Cl)C#N

Isomeric SMILES

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

InChI

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