2-[2-(4-cyanophenoxy)ethyl]propanedioic acid

Systemtic Name: 2-[2-(4-cyanophenoxy)ethyl]propanedioic acid Openeye Name: 2-[2-(4-cyanophenoxy)ethyl]propanedioic acid CAS Name: 2-[2-(4-cyanophenoxy)ethyl]propanedioic acid IUPAC Name: 2-[2-(4-cyanophenoxy)ethyl]propanedioic acid Traditional Name: 2-[2-(4-cyanophenoxy)ethyl]malonic acid Formula: C12H11NO5 MolecularWeight: 249.21944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCCC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C#N)OCCC(C(=O)O)C(=O)O

InChI

InChI=1S/C12H11NO5/c13-7-8-1-3-9(4-2-8)18-6-5-10(11(14)15)12(16)17/h1-4,10H,5-6H2,(H,14,15)(H,16,17)