1-(2-methylpropanoyloxy)ethyl 6-bromanyl-6-iodanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: 1-(2-methylpropanoyloxy)ethyl 6-bromanyl-6-iodanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: 1-(2-methylpropanoyloxy)ethyl 6-bromo-6-iodo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-bromo-6-iodo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-(2-methyl-1-oxopropoxy)ethyl ester IUPAC Name: 1-(2-methylpropanoyloxy)ethyl 6-bromo-6-iodo-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-bromo-6-iodo-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 1-isobutyryloxyethyl ester Formula: C14H19BrINO5S MolecularWeight: 520.17783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC(C)OC(=O)C1C(SC2N1C(=O)C2(Br)I)(C)C

Isomeric SMILES

CC(C)C(=O)OC(C)OC(=O)C1C(SC2N1C(=O)C2(Br)I)(C)C

InChI

InChI=1S/C14H19BrINO5S/c1-6(2)9(18)21-7(3)22-10(19)8-13(4,5)23-12-14(15,16)11(20)17(8)12/h6-8,12H,1-5H3