2,2-dimethylpropanoyloxymethyl 3-ethanoylsulfanyl-8-oxidanylidene-4,5-dithia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 3-ethanoylsulfanyl-8-oxidanylidene-4,5-dithia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 2,2-dimethylpropanoyloxymethyl 3-acetylsulfanyl-8-oxo-4,5-dithia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(acetylthio)-8-oxo-4,5-dithia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 3-acetylsulfanyl-8-oxo-4,5-dithia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(acetylthio)-8-keto-4,5-dithia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid pivaloyloxymethyl ester Formula: C14H17NO6S3 MolecularWeight: 391.48288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=C(N2C(CC2=O)SS1)C(=O)OCOC(=O)C(C)(C)C

Isomeric SMILES

CC(=O)SC1=C(N2C(CC2=O)SS1)C(=O)OCOC(=O)C(C)(C)C

InChI

InChI=1S/C14H17NO6S3/c1-7(16)22-12-10(15-8(17)5-9(15)23-24-12)11(18)20-6-21-13(19)14(2,3)4/h9H,5-6H2,1-4H3