(1-cyanoindolizin-2-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C22H22N2O5/c1-26-19-10-15(11-20(27-2)22(19)28-3)7-8-21(25)29-14-16-13-24-9-5-4-6-18(24)17(16)12-23/h4-6,9-11,13H,7-8,14H2,1-3H3