(4-cyanophenyl)methyl 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: (4-cyanophenyl)methyl 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: (4-cyanophenyl)methyl 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid (4-cyanobenzyl) ester Formula: C19H19NO4 MolecularWeight: 325.35846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)OCC2=CC=C(C=C2)C#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)OCC2=CC=C(C=C2)C#N)OC

InChI

InChI=1S/C19H19NO4/c1-22-17-9-16(10-18(11-17)23-2)7-8-19(21)24-13-15-5-3-14(12-20)4-6-15/h3-6,9-11H,7-8,13H2,1-2H3