dimethyl (1S,4R,8R)-8-ethenyl-5-azabicyclo[2.2.2]oct-2-ene-3,5-dicarboxylate

Systemtic Name: dimethyl (1S,4R,8R)-8-ethenyl-5-azabicyclo[2.2.2]oct-2-ene-3,5-dicarboxylate Openeye Name: dimethyl (1S,4R,8R)-8-vinyl-5-azabicyclo[2.2.2]oct-2-ene-3,5-dicarboxylate CAS Name: (1S,4R,8R)-8-ethenyl-5-azabicyclo[2.2.2]oct-2-ene-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,4R,8R)-8-ethenyl-5-azabicyclo[2.2.2]oct-2-ene-3,5-dicarboxylate Traditional Name: (1S,4R,8R)-8-vinyl-5-azabicyclo[2.2.2]oct-2-ene-3,5-dicarboxylic acid dimethyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2CC(C1N(C2)C(=O)OC)C=C

Isomeric SMILES

COC(=O)C1=C[C@@H]2C[C@@H]([C@H]1N(C2)C(=O)OC)C=C

InChI

InChI=1S/C13H17NO4/c1-4-9-5-8-6-10(12(15)17-2)11(9)14(7-8)13(16)18-3/h4,6,8-9,11H,1,5,7H2,2-3H3/t8-,9-,11+/m0/s1