O1,O5-bis(2-cyanoprop-2-enyl) O3-(2-isocyanoprop-2-enyl) pentane-1,3,5-tricarboxylate

Systemtic Name: O1,O5-bis(2-cyanoprop-2-enyl) O3-(2-isocyanoprop-2-enyl) pentane-1,3,5-tricarboxylate Openeye Name: O1,O5-bis(2-cyanoallyl) O3-(2-isocyanoallyl) pentane-1,3,5-tricarboxylate CAS Name: pentane-1,3,5-tricarboxylic acid O1,O5-bis(2-cyanoprop-2-enyl) ester O3-(2-isocyanoprop-2-enyl) ester IUPAC Name: 1-O,5-O-bis(2-cyanoprop-2-enyl) 3-O-(2-isocyanoprop-2-enyl) pentane-1,3,5-tricarboxylate Traditional Name: pentane-1,3,5-tricarboxylic acid O1,O5-bis(2-cyanoallyl) ester O3-(2-isocyanoallyl) ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O6/c1-14(9-21)11-27-18(24)7-5-17(20(26)29-13-16(3)23-4)6-8-19(25)28-12-15(2)10-22/h17H,1-3,5-8,11-13H2