dimethyl (1S,4R)-2-oxidanylidene-3-azabicyclo[2.2.2]octa-5,7-diene-5,6-dicarboxylate

Systemtic Name: dimethyl (1S,4R)-2-oxidanylidene-3-azabicyclo[2.2.2]octa-5,7-diene-5,6-dicarboxylate Openeye Name: dimethyl (1S,4R)-2-oxo-3-azabicyclo[2.2.2]octa-5,7-diene-5,6-dicarboxylate CAS Name: (1S,4R)-2-oxo-3-azabicyclo[2.2.2]octa-5,7-diene-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,4R)-2-oxo-3-azabicyclo[2.2.2]octa-5,7-diene-5,6-dicarboxylate Traditional Name: (1S,4R)-2-keto-3-azabicyclo[2.2.2]octa-5,7-diene-5,6-dicarboxylic acid dimethyl ester Formula: C11H11NO5 MolecularWeight: 237.20874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2C=CC1C(=O)N2)C(=O)OC

Isomeric SMILES

COC(=O)C1=C([C@H]2C=C[C@@H]1C(=O)N2)C(=O)OC

InChI

InChI=1S/C11H11NO5/c1-16-10(14)7-5-3-4-6(12-9(5)13)8(7)11(15)17-2/h3-6H,1-2H3,(H,12,13)/t5-,6+/m0/s1