3,4-bis[(E)-4-isocyanatobut-2-enyl]bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate

Systemtic Name: 3,4-bis[(E)-4-isocyanatobut-2-enyl]bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate Openeye Name: 3,4-bis[(E)-4-isocyanatobut-2-enyl]bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate CAS Name: 3,4-bis[(E)-4-isocyanatobut-2-enyl]bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate IUPAC Name: 3,4-bis[(E)-4-isocyanatobut-2-enyl]bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate Traditional Name: 3,4-bis[(E)-4-isocyanatobut-2-enyl]bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate Formula: C19H18N2O6-2 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC1(C(C2C(=O)[O-])(CC=CCN=C=O)C(=O)[O-])CC=CCN=C=O

Isomeric SMILES

C1C2C=CC1(C(C2C(=O)[O-])(C/C=C/CN=C=O)C(=O)[O-])C/C=C/CN=C=O

InChI

InChI=1S/C19H20N2O6/c22-12-20-9-3-1-6-18-8-5-14(11-18)15(16(24)25)19(18,17(26)27)7-2-4-10-21-13-23/h1-5,8,14-15H,6-7,9-11H2,(H,24,25)(H,26,27)/p-2/b3-1+,4-2+