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

Systemtic Name: 5-azanyl-2-[[3-methyl-4-(trifluoromethyl)phenyl]methyl]-1H-pyrazol-3-one Openeye Name: 5-amino-2-[[3-methyl-4-(trifluoromethyl)phenyl]methyl]-1H-pyrazol-3-one CAS Name: 5-amino-2-[[3-methyl-4-(trifluoromethyl)phenyl]methyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[[3-methyl-4-(trifluoromethyl)phenyl]methyl]-1H-pyrazol-3-one Traditional Name: 5-amino-2-[3-methyl-4-(trifluoromethyl)benzyl]-3-pyrazolin-3-one Formula: C12H12F3N3O MolecularWeight: 271.23839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN2C(=O)C=C(N2)N)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)CN2C(=O)C=C(N2)N)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O/c1-7-4-8(2-3-9(7)12(13,14)15)6-18-11(19)5-10(16)17-18/h2-5,17H,6,16H2,1H3