(1-cyanoindolizin-2-yl)methyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: (1-cyanoindolizin-2-yl)methyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-(trifluoromethyl)phenyl]-2-propenoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(trifluoromethyl)phenyl]acrylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C20H13F3N2O2 MolecularWeight: 370.32463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN2C=C1)COC(=O)C=CC3=CC(=CC=C3)C(F)(F)F)C#N

Isomeric SMILES

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

InChI

InChI=1S/C20H13F3N2O2/c21-20(22,23)16-5-3-4-14(10-16)7-8-19(26)27-13-15-12-25-9-2-1-6-18(25)17(15)11-24/h1-10,12H,13H2/b8-7+