[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-[2-(trifluoromethyl)benzimidazol-1-yl]acetate CAS Name: 2-[2-(trifluoromethyl)-1-benzimidazolyl]acetic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-[2-(trifluoromethyl)benzimidazol-1-yl]acetate Traditional Name: 2-[2-(trifluoromethyl)benzimidazol-1-yl]acetic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H13F3N4O3 MolecularWeight: 354.28393

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CC(=O)OCC(=O)NCCC#N)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CC(=O)OCC(=O)NCCC#N)C(F)(F)F

InChI

InChI=1S/C15H13F3N4O3/c16-15(17,18)14-21-10-4-1-2-5-11(10)22(14)8-13(24)25-9-12(23)20-7-3-6-19/h1-2,4-5H,3,7-9H2,(H,20,23)