4-methyl-5-phenyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one

Systemtic Name: 4-methyl-5-phenyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one Openeye Name: 4-methyl-5-phenyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one CAS Name: 4-methyl-5-phenyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one IUPAC Name: 4-methyl-5-phenyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one Traditional Name: 4-methyl-5-phenyl-2-[1-[4-(trifluoromethyl)phenyl]ethyl]-3-pyrazolin-3-one Formula: C19H17F3N2O MolecularWeight: 346.34629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN(C1=O)C(C)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC1=C(NN(C1=O)C(C)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C19H17F3N2O/c1-12-17(15-6-4-3-5-7-15)23-24(18(12)25)13(2)14-8-10-16(11-9-14)19(20,21)22/h3-11,13,23H,1-2H3