4-[[(4-methylphenyl)amino]methylidene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one

Systemtic Name: 4-[[(4-methylphenyl)amino]methylidene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 4-[(4-methylanilino)methylene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one CAS Name: 4-[(4-methylanilino)methylidene]-2-phenyl-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 4-[(4-methylanilino)methylidene]-2-phenyl-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 2-phenyl-4-(p-toluidinomethylene)-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C18H14F3N3O MolecularWeight: 345.31847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC=C2C(=NN(C2=O)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)NC=C2C(=NN(C2=O)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N3O/c1-12-7-9-13(10-8-12)22-11-15-16(18(19,20)21)23-24(17(15)25)14-5-3-2-4-6-14/h2-11,22H,1H3