ethyl 3-isocyanatobicyclo[2.2.2]oct-5-ene-2-carboxylate

Systemtic Name: ethyl 3-isocyanatobicyclo[2.2.2]oct-5-ene-2-carboxylate Openeye Name: ethyl 3-isocyanatobicyclo[2.2.2]oct-5-ene-2-carboxylate CAS Name: 3-isocyanato-2-bicyclo[2.2.2]oct-5-enecarboxylic acid ethyl ester IUPAC Name: ethyl 3-isocyanatobicyclo[2.2.2]oct-5-ene-2-carboxylate Traditional Name: 3-isocyanatobicyclo[2.2.2]oct-5-ene-2-carboxylic acid ethyl ester Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2CCC(C1N=C=O)C=C2

Isomeric SMILES

CCOC(=O)C1C2CCC(C1N=C=O)C=C2

InChI

InChI=1S/C12H15NO3/c1-2-16-12(15)10-8-3-5-9(6-4-8)11(10)13-7-14/h3,5,8-11H,2,4,6H2,1H3