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

Systemtic Name: 2-[[4-chloranyl-3-(trifluoromethyl)phenyl]methyl]-5-methyl-4-phenyl-1H-pyrazol-3-one Openeye Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-5-methyl-4-phenyl-1H-pyrazol-3-one CAS Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-5-methyl-4-phenyl-1H-pyrazol-3-one IUPAC Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-5-methyl-4-phenyl-1H-pyrazol-3-one Traditional Name: 2-[4-chloro-3-(trifluoromethyl)benzyl]-5-methyl-4-phenyl-3-pyrazolin-3-one Formula: C18H14ClF3N2O MolecularWeight: 366.76477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)CC2=CC(=C(C=C2)Cl)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N(N1)CC2=CC(=C(C=C2)Cl)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C18H14ClF3N2O/c1-11-16(13-5-3-2-4-6-13)17(25)24(23-11)10-12-7-8-15(19)14(9-12)18(20,21)22/h2-9,23H,10H2,1H3