sodium 6-(1-hydroxyethyl)-3-(methoxymethylsulfanyl)-4-methyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium 6-(1-hydroxyethyl)-3-(methoxymethylsulfanyl)-4-methyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium 6-(1-hydroxyethyl)-3-(methoxymethylsulfanyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium 6-(1-hydroxyethyl)-3-(methoxymethylthio)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium 6-(1-hydroxyethyl)-3-(methoxymethylsulfanyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium 6-(1-hydroxyethyl)-7-keto-3-(methoxymethylthio)-4-methyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C12H16NNaO5S MolecularWeight: 309.31391

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C(=O)N2C(=C1SCOC)C(=O)[O-])C(C)O.[Na+]

Isomeric SMILES

CC1C2C(C(=O)N2C(=C1SCOC)C(=O)[O-])C(C)O.[Na+]

InChI

InChI=1S/C12H17NO5S.Na/c1-5-8-7(6(2)14)11(15)13(8)9(12(16)17)10(5)19-4-18-3;/h5-8,14H,4H2,1-3H3,(H,16,17);/q;+1/p-1