bis(2-cyanoprop-2-enyl) 4-(2-isocyanoprop-2-enylperoxymethyl)heptanedioate

Systemtic Name: bis(2-cyanoprop-2-enyl) 4-(2-isocyanoprop-2-enylperoxymethyl)heptanedioate Openeye Name: bis(2-cyanoallyl) 4-(2-isocyanoallylperoxymethyl)heptanedioate CAS Name: 4-(2-isocyanoprop-2-enyldioxymethyl)heptanedioic acid bis(2-cyanoprop-2-enyl) ester IUPAC Name: bis(2-cyanoprop-2-enyl) 4-(2-isocyanoprop-2-enylperoxymethyl)heptanedioate Traditional Name: 4-(2-isocyanoallylperoxymethyl)pimelic acid bis(2-cyanoallyl) ester Formula: C20H23N3O6 MolecularWeight: 401.41312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(COC(=O)CCC(CCC(=O)OCC(=C)C#N)COOCC(=C)[N+]#[C-])C#N

Isomeric SMILES

C=C(COC(=O)CCC(CCC(=O)OCC(=C)C#N)COOCC(=C)[N+]#[C-])C#N

InChI

InChI=1S/C20H23N3O6/c1-15(9-21)11-26-19(24)7-5-18(14-29-28-13-17(3)23-4)6-8-20(25)27-12-16(2)10-22/h18H,1-3,5-8,11-14H2