1-ethoxycarbonyloxyethyl 6-bromanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: 1-ethoxycarbonyloxyethyl 6-bromanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: 1-ethoxycarbonyloxyethyl 6-bromo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-bromo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-ethoxycarbonyloxyethyl ester IUPAC Name: 1-ethoxycarbonyloxyethyl 6-bromo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-bromo-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-carbethoxyoxyethyl ester Formula: C13H18BrNO6S MolecularWeight: 396.25412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(C)OC(=O)C1C(SC2N1C(=O)C2Br)(C)C

Isomeric SMILES

CCOC(=O)OC(C)OC(=O)C1C(SC2N1C(=O)C2Br)(C)C

InChI

InChI=1S/C13H18BrNO6S/c1-5-19-12(18)21-6(2)20-11(17)8-13(3,4)22-10-7(14)9(16)15(8)10/h6-8,10H,5H2,1-4H3