7-acetamido-3-[(E)-carboxymethyloxyiminomethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-acetamido-3-[(E)-carboxymethyloxyiminomethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-acetamido-3-[(E)-carboxymethyloxyiminomethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-acetamido-3-[(E)-carboxymethyloxyiminomethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-acetamido-3-[(E)-carboxymethyloxyiminomethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-acetamido-3-[(E)-carboxymethyloximinomethyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C12H13N3O7S MolecularWeight: 343.31252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)NC1C2N(C1=O)C(=C(CS2)/C=N/OCC(=O)O)C(=O)O

InChI

InChI=1S/C12H13N3O7S/c1-5(16)14-8-10(19)15-9(12(20)21)6(4-23-11(8)15)2-13-22-3-7(17)18/h2,8,11H,3-4H2,1H3,(H,14,16)(H,17,18)(H,20,21)/b13-2+