dimethyl 2,5-dicyanohexanedioate

Systemtic Name: dimethyl 2,5-dicyanohexanedioate Openeye Name: dimethyl 2,5-dicyanohexanedioate CAS Name: 2,5-dicyanohexanedioic acid dimethyl ester IUPAC Name: dimethyl 2,5-dicyanohexanedioate Traditional Name: 2,5-dicyanoadipic acid dimethyl ester Formula: C10H12N2O4 MolecularWeight: 224.21328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(C#N)C(=O)OC)C#N

Isomeric SMILES

COC(=O)C(CCC(C#N)C(=O)OC)C#N

InChI

InChI=1S/C10H12N2O4/c1-15-9(13)7(5-11)3-4-8(6-12)10(14)16-2/h7-8H,3-4H2,1-2H3