4-[[4-(ethylamino)phenyl]methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[[4-(ethylamino)phenyl]methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one Openeye Name: 4-[[4-(ethylamino)phenyl]methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one CAS Name: 4-[[4-(ethylamino)phenyl]methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[[4-(ethylamino)phenyl]methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one Traditional Name: 4-[4-(ethylamino)benzyl]-5-(trifluoromethyl)-3-pyrazolin-3-one Formula: C13H14F3N3O MolecularWeight: 285.26497

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(C=C1)CC2=C(NNC2=O)C(F)(F)F

Isomeric SMILES

CCNC1=CC=C(C=C1)CC2=C(NNC2=O)C(F)(F)F

InChI

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