4-methyl-5-pyridin-3-yl-2-[4-(trifluoromethyl)phenyl]-4H-pyrazol-3-one

Systemtic Name: 4-methyl-5-pyridin-3-yl-2-[4-(trifluoromethyl)phenyl]-4H-pyrazol-3-one Openeye Name: 4-methyl-5-(3-pyridyl)-2-[4-(trifluoromethyl)phenyl]-4H-pyrazol-3-one CAS Name: 4-methyl-5-(3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]-4H-pyrazol-3-one IUPAC Name: 4-methyl-5-pyridin-3-yl-2-[4-(trifluoromethyl)phenyl]-4H-pyrazol-3-one Traditional Name: 4-methyl-5-(3-pyridyl)-2-[4-(trifluoromethyl)phenyl]-2-pyrazolin-3-one Formula: C16H12F3N3O MolecularWeight: 319.28119

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NN(C1=O)C2=CC=C(C=C2)C(F)(F)F)C3=CN=CC=C3

Isomeric SMILES

CC1C(=NN(C1=O)C2=CC=C(C=C2)C(F)(F)F)C3=CN=CC=C3

InChI

InChI=1S/C16H12F3N3O/c1-10-14(11-3-2-8-20-9-11)21-22(15(10)23)13-6-4-12(5-7-13)16(17,18)19/h2-10H,1H3