sodium 6-(1-acetyloxy-2-oxidanylidene-2-phenyl-ethyl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: sodium 6-(1-acetyloxy-2-oxidanylidene-2-phenyl-ethyl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: sodium 6-(1-acetoxy-2-oxo-2-phenyl-ethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: sodium 6-(1-acetyloxy-2-oxo-2-phenylethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate IUPAC Name: sodium 6-(1-acetyloxy-2-oxo-2-phenylethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: sodium 6-(1-acetoxy-2-keto-2-phenyl-ethyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Formula: C18H18NNaO6S MolecularWeight: 399.39339

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1C2N(C1=O)C(C(S2)(C)C)C(=O)[O-])C(=O)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CC(=O)OC(C1C2N(C1=O)C(C(S2)(C)C)C(=O)[O-])C(=O)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C18H19NO6S.Na/c1-9(20)25-13(12(21)10-7-5-4-6-8-10)11-15(22)19-14(17(23)24)18(2,3)26-16(11)19;/h4-8,11,13-14,16H,1-3H3,(H,23,24);/q;+1/p-1