1-methyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde

Systemtic Name: 1-methyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde Openeye Name: 1-methyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde CAS Name: 1-methyl-5-(trifluoromethyl)-4-pyrazolecarboxaldehyde IUPAC Name: 1-methyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde Traditional Name: 1-methyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde Formula: C6H5F3N2O MolecularWeight: 178.11191

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C=O)C(F)(F)F

Isomeric SMILES

CN1C(=C(C=N1)C=O)C(F)(F)F

InChI

InChI=1S/C6H5F3N2O/c1-11-5(6(7,8)9)4(3-12)2-10-11/h2-3H,1H3