[2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 2,6-bis(fluoranyl)benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-phenyldiazenylphenyl)amino]ethyl] 2,6-bis(fluoranyl)benzoate Openeye Name: [2-oxo-2-(4-phenylazoanilino)ethyl] 2,6-difluorobenzoate CAS Name: 2,6-difluorobenzoic acid [2-oxo-2-(4-phenyldiazenylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenyldiazenylanilino)ethyl] 2,6-difluorobenzoate Traditional Name: 2,6-difluorobenzoic acid [2-keto-2-(4-phenylazoanilino)ethyl] ester Formula: C21H15F2N3O3 MolecularWeight: 395.358906

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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=C(C=CC=C3F)F

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC=C3F)F

InChI

InChI=1S/C21H15F2N3O3/c22-17-7-4-8-18(23)20(17)21(28)29-13-19(27)24-14-9-11-16(12-10-14)26-25-15-5-2-1-3-6-15/h1-12H,13H2,(H,24,27)