[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl] 2-(3-fluorophenyl)ethanoate

Systemtic Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl] 2-(3-fluorophenyl)ethanoate Openeye Name: [(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxo-propyl] 2-(3-fluorophenyl)acetate CAS Name: 2-(3-fluorophenyl)acetic 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] 2-(3-fluorophenyl)acetate Traditional Name: 2-(3-fluorophenyl)acetic acid [(3E)-3-cyano-2-keto-3-(3-methyl-1H-benzimidazol-2-ylidene)propyl] ester Formula: C20H16FN3O3 MolecularWeight: 365.357743

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2NC1=C(C#N)C(=O)COC(=O)CC3=CC(=CC=C3)F

Isomeric SMILES

CN\1C2=CC=CC=C2N/C1=C(/C#N)\C(=O)COC(=O)CC3=CC(=CC=C3)F

InChI

InChI=1S/C20H16FN3O3/c1-24-17-8-3-2-7-16(17)23-20(24)15(11-22)18(25)12-27-19(26)10-13-5-4-6-14(21)9-13/h2-9,23H,10,12H2,1H3/b20-15+