sodium (5R,6R)-3-tert-butyl-6-(methylsulfonylaminomethyl)-7-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium (5R,6R)-3-tert-butyl-6-(methylsulfonylaminomethyl)-7-oxidanylidene-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium (5R,6R)-3-tert-butyl-6-(methanesulfonamidomethyl)-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium (5R,6R)-3-tert-butyl-6-(methanesulfonamidomethyl)-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium (5R,6R)-3-tert-butyl-6-(methanesulfonamidomethyl)-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium (5R,6R)-3-tert-butyl-7-keto-6-(methanesulfonamidomethyl)-4-oxa-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C12H17N2NaO6S MolecularWeight: 340.32795

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(N2C(O1)C(C2=O)CNS(=O)(=O)C)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)(C)C1=C(N2[C@H](O1)[C@H](C2=O)CNS(=O)(=O)C)C(=O)[O-].[Na+]

InChI

InChI=1S/C12H18N2O6S.Na/c1-12(2,3)8-7(11(16)17)14-9(15)6(10(14)20-8)5-13-21(4,18)19;/h6,10,13H,5H2,1-4H3,(H,16,17);/q;+1/p-1/t6-,10+;/m0./s1