sodium 3-(acetyloxymethyl)-8-oxidanylidene-7-phenylmethoxy-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: sodium 3-(acetyloxymethyl)-8-oxidanylidene-7-phenylmethoxy-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: sodium 3-(acetoxymethyl)-7-benzyloxy-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: sodium 3-(acetyloxymethyl)-8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-7-phenylmethoxy-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: sodium 3-(acetyloxymethyl)-8-oxo-7-phenylmethoxy-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: sodium 3-(acetoxymethyl)-7-benzoxy-8-keto-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C23H21N2NaO7S2 MolecularWeight: 524.54181

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=C(N2C(C(C2=O)(NC(=O)CC3=CC=CS3)OCC4=CC=CC=C4)SC1)C(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)OCC1=C(N2C(C(C2=O)(NC(=O)CC3=CC=CS3)OCC4=CC=CC=C4)SC1)C(=O)[O-].[Na+]

InChI

InChI=1S/C23H22N2O7S2.Na/c1-14(26)31-12-16-13-34-22-23(21(30)25(22)19(16)20(28)29,32-11-15-6-3-2-4-7-15)24-18(27)10-17-8-5-9-33-17;/h2-9,22H,10-13H2,1H3,(H,24,27)(H,28,29);/q;+1/p-1