2,2-dimethylpropanoyloxymethyl 7-oxidanylidene-3-phenylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 7-oxidanylidene-3-phenylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 2,2-dimethylpropanoyloxymethyl 7-oxo-3-phenylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 7-oxo-3-(phenylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 7-oxo-3-phenylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 7-keto-3-(phenylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid pivaloyloxymethyl ester Formula: C19H21NO5S MolecularWeight: 375.43874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOC(=O)C1=C(CC2N1C(=O)C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)OCOC(=O)C1=C(CC2N1C(=O)C2)SC3=CC=CC=C3

InChI

InChI=1S/C19H21NO5S/c1-19(2,3)18(23)25-11-24-17(22)16-14(9-12-10-15(21)20(12)16)26-13-7-5-4-6-8-13/h4-8,12H,9-11H2,1-3H3