cyanomethyl 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: cyanomethyl 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: cyanomethyl 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propionic acid cyanomethyl ester Formula: C15H15N3O5 MolecularWeight: 317.2967

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)CCC(=O)OCC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)CCC(=O)OCC#N)OC

InChI

InChI=1S/C15H15N3O5/c1-20-11-4-3-10(9-12(11)21-2)15-17-13(23-18-15)5-6-14(19)22-8-7-16/h3-4,9H,5-6,8H2,1-2H3