[[(2E)-2-cyclopropyloxyiminoethanoyl]amino] 3-ethynyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: [[(2E)-2-cyclopropyloxyiminoethanoyl]amino] 3-ethynyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: [[(2E)-2-(cyclopropoxyimino)acetyl]amino] 3-ethynyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-ethynyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid [[(2E)-2-cyclopropyloxyimino-1-oxoethyl]amino] ester IUPAC Name: [[(2E)-2-cyclopropyloxyiminoacetyl]amino] 3-ethynyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-ethynyl-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid [[(2E)-2-cyclopropyloximinoacetyl]amino] ester Formula: C14H13N3O5S MolecularWeight: 335.33512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C(N2C(CC2=O)SC1)C(=O)ONC(=O)C=NOC3CC3

Isomeric SMILES

C#CC1=C(N2C(CC2=O)SC1)C(=O)ONC(=O)/C=N/OC3CC3

InChI

InChI=1S/C14H13N3O5S/c1-2-8-7-23-12-5-11(19)17(12)13(8)14(20)22-16-10(18)6-15-21-9-3-4-9/h1,6,9,12H,3-5,7H2,(H,16,18)/b15-6+