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

Systemtic Name: butanoyloxymethyl 6-bromanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: butanoyloxymethyl 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-oxobutoxymethyl ester IUPAC Name: butanoyloxymethyl 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 butyryloxymethyl ester Formula: C13H18BrNO5S MolecularWeight: 380.25472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCOC(=O)C1C(SC2N1C(=O)C2Br)(C)C

Isomeric SMILES

CCCC(=O)OCOC(=O)C1C(SC2N1C(=O)C2Br)(C)C

InChI

InChI=1S/C13H18BrNO5S/c1-4-5-7(16)19-6-20-12(18)9-13(2,3)21-11-8(14)10(17)15(9)11/h8-9,11H,4-6H2,1-3H3