sodium (6S)-7-azanyl-3-(hydroxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: sodium (6S)-7-azanyl-3-(hydroxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: sodium (6S)-7-amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: sodium (6S)-7-amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: sodium (6S)-7-amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: sodium (6S)-7-amino-8-keto-3-methylol-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C8H9N2NaO4S MolecularWeight: 252.22283

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)[O-])CO.[Na+]

Isomeric SMILES

C1C(=C(N2[C@@H](S1)C(C2=O)N)C(=O)[O-])CO.[Na+]

InChI

InChI=1S/C8H10N2O4S.Na/c9-4-6(12)10-5(8(13)14)3(1-11)2-15-7(4)10;/h4,7,11H,1-2,9H2,(H,13,14);/q;+1/p-1/t4?,7-;/m0./s1