[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl] 3,5-bis(fluoranyl)benzoate

Systemtic Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl] 3,5-bis(fluoranyl)benzoate Openeye Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxo-propyl] 3,5-difluorobenzoate CAS Name: 3,5-difluorobenzoic acid [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl] ester IUPAC Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl] 3,5-difluorobenzoate Traditional Name: 3,5-difluorobenzoic acid [(3E)-3-cyano-2-keto-3-(3-methyl-1H-benzimidazol-2-ylidene)propyl] ester Formula: C19H13F2N3O3 MolecularWeight: 369.321626

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2NC1=C(C#N)C(=O)COC(=O)C3=CC(=CC(=C3)F)F

Isomeric SMILES

CN\1C2=CC=CC=C2N/C1=C(/C#N)\C(=O)COC(=O)C3=CC(=CC(=C3)F)F

InChI

InChI=1S/C19H13F2N3O3/c1-24-16-5-3-2-4-15(16)23-18(24)14(9-22)17(25)10-27-19(26)11-6-12(20)8-13(21)7-11/h2-8,23H,10H2,1H3/b18-14+