3-[4-cyano-3-(oxiran-2-ylmethoxy)phenyl]propanoate

Systemtic Name: 3-[4-cyano-3-(oxiran-2-ylmethoxy)phenyl]propanoate Openeye Name: 3-[4-cyano-3-(oxiran-2-ylmethoxy)phenyl]propanoate CAS Name: 3-[4-cyano-3-(2-oxiranylmethoxy)phenyl]propanoate IUPAC Name: 3-[4-cyano-3-(oxiran-2-ylmethoxy)phenyl]propanoate Traditional Name: 3-(4-cyano-3-glycidoxy-phenyl)propionate Formula: C13H12NO4- MolecularWeight: 246.23868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)COC2=C(C=CC(=C2)CCC(=O)[O-])C#N

Isomeric SMILES

C1C(O1)COC2=C(C=CC(=C2)CCC(=O)[O-])C#N

InChI

InChI=1S/C13H13NO4/c14-6-10-3-1-9(2-4-13(15)16)5-12(10)18-8-11-7-17-11/h1,3,5,11H,2,4,7-8H2,(H,15,16)/p-1