dimethyl (2S,6E)-10-oxidanylidene-2,3,4,5,8,9-hexahydro-1H-azecine-2,9-dicarboxylate

Systemtic Name: dimethyl (2S,6E)-10-oxidanylidene-2,3,4,5,8,9-hexahydro-1H-azecine-2,9-dicarboxylate Openeye Name: dimethyl (2S,6E)-10-oxo-2,3,4,5,8,9-hexahydro-1H-azecine-2,9-dicarboxylate CAS Name: (2S,6E)-10-oxo-2,3,4,5,8,9-hexahydro-1H-azecine-2,9-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,6E)-10-oxo-2,3,4,5,8,9-hexahydro-1H-azecine-2,9-dicarboxylate Traditional Name: (2S,6E)-10-keto-2,3,4,5,8,9-hexahydro-1H-azecine-2,9-dicarboxylic acid dimethyl ester Formula: C13H19NO5 MolecularWeight: 269.29366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCC=CCC(C(=O)N1)C(=O)OC

Isomeric SMILES

COC(=O)[C@@H]1CCC/C=C/CC(C(=O)N1)C(=O)OC

InChI

InChI=1S/C13H19NO5/c1-18-12(16)9-7-5-3-4-6-8-10(13(17)19-2)14-11(9)15/h3,5,9-10H,4,6-8H2,1-2H3,(H,14,15)/b5-3+/t9?,10-/m0/s1