3-(acetyloxymethyl)-7-azanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; methanamide

Systemtic Name: 3-(acetyloxymethyl)-7-azanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; methanamide Openeye Name: 3-(acetoxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; formamide CAS Name: 3-(acetyloxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; formamide IUPAC Name: 3-(acetyloxymethyl)-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; formamide Traditional Name: 3-(acetoxymethyl)-7-amino-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid; formamide Formula: C11H15N3O6S MolecularWeight: 317.3183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(N2C(C(C2=O)N)SC1)C(=O)O.C(=O)N

Isomeric SMILES

CC(=O)OCC1=C(N2C(C(C2=O)N)SC1)C(=O)O.C(=O)N

InChI

InChI=1S/C10H12N2O5S.CH3NO/c1-4(13)17-2-5-3-18-9-6(11)8(14)12(9)7(5)10(15)16;2-1-3/h6,9H,2-3,11H2,1H3,(H,15,16);1H,(H2,2,3)