3,7-diacetamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3,7-diacetamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3,7-diacetamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3,7-diacetamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3,7-diacetamido-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3,7-diacetamido-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C11H13N3O5S MolecularWeight: 299.30302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C2N(C1=O)C(=C(CS2)NC(=O)C)C(=O)O

Isomeric SMILES

CC(=O)NC1C2N(C1=O)C(=C(CS2)NC(=O)C)C(=O)O

InChI

InChI=1S/C11H13N3O5S/c1-4(15)12-6-3-20-10-7(13-5(2)16)9(17)14(10)8(6)11(18)19/h7,10H,3H2,1-2H3,(H,12,15)(H,13,16)(H,18,19)