(1-cyanoindolizin-2-yl)methyl 4-(trifluoromethyloxy)benzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 4-(trifluoromethyloxy)benzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 4-(trifluoromethoxy)benzoate CAS Name: 4-(trifluoromethoxy)benzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 4-(trifluoromethoxy)benzoate Traditional Name: 4-(trifluoromethoxy)benzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C18H11F3N2O3 MolecularWeight: 360.28675

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN2C=C1)COC(=O)C3=CC=C(C=C3)OC(F)(F)F)C#N

Isomeric SMILES

C1=CC2=C(C(=CN2C=C1)COC(=O)C3=CC=C(C=C3)OC(F)(F)F)C#N

InChI

InChI=1S/C18H11F3N2O3/c19-18(20,21)26-14-6-4-12(5-7-14)17(24)25-11-13-10-23-8-2-1-3-16(23)15(13)9-22/h1-8,10H,11H2