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

Systemtic Name: 5-azanyl-2-[[4-chloranyl-3-(trifluoromethyl)phenyl]methyl]-4-methyl-1H-pyrazol-3-one Openeye Name: 5-amino-2-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-4-methyl-1H-pyrazol-3-one CAS Name: 5-amino-2-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-4-methyl-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[[4-chloro-3-(trifluoromethyl)phenyl]methyl]-4-methyl-1H-pyrazol-3-one Traditional Name: 5-amino-2-[4-chloro-3-(trifluoromethyl)benzyl]-4-methyl-3-pyrazolin-3-one Formula: C12H11ClF3N3O MolecularWeight: 305.68345

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClF3N3O/c1-6-10(17)18-19(11(6)20)5-7-2-3-9(13)8(4-7)12(14,15)16/h2-4,18H,5,17H2,1H3