[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 4-(trifluoromethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 4-(trifluoromethyl)benzoate Openeye Name: [2-oxo-2-(4-phenylazoanilino)ethyl] 4-(trifluoromethyl)benzoate CAS Name: 4-(trifluoromethyl)benzoic acid [2-oxo-2-(4-phenyldiazenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenyldiazenylanilino)ethyl] 4-(trifluoromethyl)benzoate Traditional Name: 4-(trifluoromethyl)benzoic acid [2-keto-2-(4-phenylazoanilino)ethyl] ester Formula: C22H16F3N3O3 MolecularWeight: 427.37595

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)COC(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H16F3N3O3/c23-22(24,25)16-8-6-15(7-9-16)21(30)31-14-20(29)26-17-10-12-19(13-11-17)28-27-18-4-2-1-3-5-18/h1-13H,14H2,(H,26,29)