diethyl 5-ethanoylsulfanyl-2,3-diazabicyclo[2.2.1]heptane-2,3-dicarboxylate

Systemtic Name: diethyl 5-ethanoylsulfanyl-2,3-diazabicyclo[2.2.1]heptane-2,3-dicarboxylate Openeye Name: diethyl 5-acetylsulfanyl-2,3-diazabicyclo[2.2.1]heptane-2,3-dicarboxylate CAS Name: 5-(acetylthio)-2,3-diazabicyclo[2.2.1]heptane-2,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-acetylsulfanyl-2,3-diazabicyclo[2.2.1]heptane-2,3-dicarboxylate Traditional Name: 5-(acetylthio)-2,3-diazabicyclo[2.2.1]heptane-2,3-dicarboxylic acid diethyl ester Formula: C13H20N2O5S MolecularWeight: 316.3733

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2CC(N1C(=O)OCC)C(C2)SC(=O)C

Isomeric SMILES

CCOC(=O)N1C2CC(N1C(=O)OCC)C(C2)SC(=O)C

InChI

InChI=1S/C13H20N2O5S/c1-4-19-12(17)14-9-6-10(11(7-9)21-8(3)16)15(14)13(18)20-5-2/h9-11H,4-7H2,1-3H3