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

Systemtic Name: O1,O5-bis(2-cyanoprop-2-enyl) O3-(2-isocyanoprop-2-enyl) benzene-1,3,5-tricarboxylate Openeye Name: O1,O5-bis(2-cyanoallyl) O3-(2-isocyanoallyl) benzene-1,3,5-tricarboxylate CAS Name: benzene-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) benzene-1,3,5-tricarboxylate Traditional Name: benzene-1,3,5-tricarboxylic acid O1,O5-bis(2-cyanoallyl) ester O3-(2-isocyanoallyl) ester Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COC(=O)C1=CC(=CC(=C1)C(=O)OCC(=C)[N+]#[C-])C(=O)OCC(=C)C#N)C#N

Isomeric SMILES

C=C(COC(=O)C1=CC(=CC(=C1)C(=O)OCC(=C)[N+]#[C-])C(=O)OCC(=C)C#N)C#N

InChI

InChI=1S/C21H15N3O6/c1-13(8-22)10-28-19(25)16-5-17(20(26)29-11-14(2)9-23)7-18(6-16)21(27)30-12-15(3)24-4/h5-7H,1-3,10-12H2