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

Systemtic Name: 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde Openeye Name: 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde CAS Name: 3-methyl-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxaldehyde IUPAC Name: 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde Traditional Name: 3-methyl-1-phenyl-5-(trifluoromethyl)pyrazole-4-carbaldehyde Formula: C12H9F3N2O MolecularWeight: 254.20787

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)C(F)(F)F)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C=O)C(F)(F)F)C2=CC=CC=C2

InChI

InChI=1S/C12H9F3N2O/c1-8-10(7-18)11(12(13,14)15)17(16-8)9-5-3-2-4-6-9/h2-7H,1H3