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

Systemtic Name: 2-(4-nitrophenyl)-4-[[(2-phenylphenyl)amino]methylidene]-5-(trifluoromethyl)pyrazol-3-one Openeye Name: 2-(4-nitrophenyl)-4-[(2-phenylanilino)methylene]-5-(trifluoromethyl)pyrazol-3-one CAS Name: 2-(4-nitrophenyl)-4-[(2-phenylanilino)methylidene]-5-(trifluoromethyl)-3-pyrazolone IUPAC Name: 2-(4-nitrophenyl)-4-[(2-phenylanilino)methylidene]-5-(trifluoromethyl)pyrazol-3-one Traditional Name: 2-(4-nitrophenyl)-4-[(2-phenylanilino)methylene]-5-(trifluoromethyl)-2-pyrazolin-3-one Formula: C23H15F3N4O3 MolecularWeight: 452.38541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2NC=C3C(=NN(C3=O)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2NC=C3C(=NN(C3=O)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C23H15F3N4O3/c24-23(25,26)21-19(22(31)29(28-21)16-10-12-17(13-11-16)30(32)33)14-27-20-9-5-4-8-18(20)15-6-2-1-3-7-15/h1-14,27H