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

Systemtic Name: 5-azanyl-4-methyl-2-[[4-(trifluoromethyloxy)phenyl]methyl]-1H-pyrazol-3-one Openeye Name: 5-amino-4-methyl-2-[[4-(trifluoromethoxy)phenyl]methyl]-1H-pyrazol-3-one CAS Name: 5-amino-4-methyl-2-[[4-(trifluoromethoxy)phenyl]methyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-4-methyl-2-[[4-(trifluoromethoxy)phenyl]methyl]-1H-pyrazol-3-one Traditional Name: 5-amino-4-methyl-2-[4-(trifluoromethoxy)benzyl]-3-pyrazolin-3-one Formula: C12H12F3N3O2 MolecularWeight: 287.23779

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NN(C1=O)CC2=CC=C(C=C2)OC(F)(F)F)N

Isomeric SMILES

CC1=C(NN(C1=O)CC2=CC=C(C=C2)OC(F)(F)F)N

InChI

InChI=1S/C12H12F3N3O2/c1-7-10(16)17-18(11(7)19)6-8-2-4-9(5-3-8)20-12(13,14)15/h2-5,17H,6,16H2,1H3