(3,4-dimethoxyphenyl)methyl 3-cyanobenzoate

Systemtic Name: (3,4-dimethoxyphenyl)methyl 3-cyanobenzoate Openeye Name: (3,4-dimethoxyphenyl)methyl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid (3,4-dimethoxyphenyl)methyl ester IUPAC Name: (3,4-dimethoxyphenyl)methyl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid veratryl ester Formula: C17H15NO4 MolecularWeight: 297.3053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO4/c1-20-15-7-6-13(9-16(15)21-2)11-22-17(19)14-5-3-4-12(8-14)10-18/h3-9H,11H2,1-2H3