4-[[(2-ethylphenyl)amino]methylidene]-2-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-one

Systemtic Name: 4-[[(2-ethylphenyl)amino]methylidene]-2-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 4-[(2-ethylanilino)methylene]-2-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-one CAS Name: 4-[(2-ethylanilino)methylidene]-2-(4-nitrophenyl)-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 4-[(2-ethylanilino)methylidene]-2-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 4-[(2-ethylanilino)methylene]-2-(4-nitrophenyl)-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C19H15F3N4O3 MolecularWeight: 404.34261

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC=C2C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCC1=CC=CC=C1NC=C2C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C19H15F3N4O3/c1-2-12-5-3-4-6-16(12)23-11-15-17(19(20,21)22)24-25(18(15)27)13-7-9-14(10-8-13)26(28)29/h3-11,23H,2H2,1H3