2-methoxycarbonyl-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid

Systemtic Name: 2-methoxycarbonyl-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid Openeye Name: 2-methoxycarbonyl-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid CAS Name: 2-methoxycarbonyl-8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid IUPAC Name: 2-methoxycarbonyl-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid Traditional Name: 2-carbomethoxy-8-keto-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-3-carboxylic acid Formula: C15H14N2O6S2 MolecularWeight: 382.41146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CSC2N1C(=O)C2NC(=O)CC3=CC=CS3)C(=O)O

Isomeric SMILES

COC(=O)C1=C(CSC2N1C(=O)C2NC(=O)CC3=CC=CS3)C(=O)O

InChI

InChI=1S/C15H14N2O6S2/c1-23-15(22)11-8(14(20)21)6-25-13-10(12(19)17(11)13)16-9(18)5-7-3-2-4-24-7/h2-4,10,13H,5-6H2,1H3,(H,16,18)(H,20,21)