tert-butyl 3-isocyanatobicyclo[2.2.1]hept-5-ene-2-carboxylate

Systemtic Name: tert-butyl 3-isocyanatobicyclo[2.2.1]hept-5-ene-2-carboxylate Openeye Name: tert-butyl 3-isocyanatobicyclo[2.2.1]hept-5-ene-2-carboxylate CAS Name: 3-isocyanato-2-bicyclo[2.2.1]hept-5-enecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-isocyanatobicyclo[2.2.1]hept-5-ene-2-carboxylate Traditional Name: 3-isocyanatobicyclo[2.2.1]hept-5-ene-2-carboxylic acid tert-butyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C2CC(C1N=C=O)C=C2

Isomeric SMILES

CC(C)(C)OC(=O)C1C2CC(C1N=C=O)C=C2

InChI

InChI=1S/C13H17NO3/c1-13(2,3)17-12(16)10-8-4-5-9(6-8)11(10)14-7-15/h4-5,8-11H,6H2,1-3H3