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

Systemtic Name: 5-azanyl-2-[1-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one Openeye Name: 5-amino-2-[1-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one CAS Name: 5-amino-2-[1-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[1-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]-1H-pyrazol-3-one Traditional Name: 5-amino-2-[1-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]-3-pyrazolin-3-one Formula: C13H14F3N3O MolecularWeight: 285.26497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)N2C(=O)C=C(N2)N)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)N2C(=O)C=C(N2)N)C(F)(F)F

InChI

InChI=1S/C13H14F3N3O/c1-7-3-4-9(5-10(7)13(14,15)16)8(2)19-12(20)6-11(17)18-19/h3-6,8,18H,17H2,1-2H3