sodium 3-acetyloxy-7-oxidanylidene-6-(2-thiophen-2-ylethanoylamino)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium 3-acetyloxy-7-oxidanylidene-6-(2-thiophen-2-ylethanoylamino)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium 3-acetoxy-7-oxo-6-[[2-(2-thienyl)acetyl]amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium 3-acetyloxy-7-oxo-6-[(1-oxo-2-thiophen-2-ylethyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium 3-acetyloxy-7-oxo-6-[(2-thiophen-2-ylacetyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium 3-acetoxy-7-keto-6-[[2-(2-thienyl)acetyl]amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C15H13N2NaO6S MolecularWeight: 372.32829

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(N2C(C1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)OC1=C(N2C(C1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)[O-].[Na+]

InChI

InChI=1S/C15H14N2O6S.Na/c1-7(18)23-10-6-9-12(14(20)17(9)13(10)15(21)22)16-11(19)5-8-3-2-4-24-8;/h2-4,9,12H,5-6H2,1H3,(H,16,19)(H,21,22);/q;+1/p-1