sodium 2-azanyl-3-[(2-carboxy-6-ethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)sulfanyl]propanoate

Systemtic Name: sodium 2-azanyl-3-[(2-carboxy-6-ethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)sulfanyl]propanoate Openeye Name: sodium 2-amino-3-[(2-carboxy-6-ethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)sulfanyl]propanoate CAS Name: sodium 2-amino-3-[(2-carboxy-6-ethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)thio]propanoate IUPAC Name: sodium 2-amino-3-[(2-carboxy-6-ethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)sulfanyl]propanoate Traditional Name: sodium 2-amino-3-[(2-carboxy-6-ethyl-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)thio]propionate Formula: C11H13N2NaO5S2 MolecularWeight: 340.35109

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2N(C1=O)C(=C(S2)SCC(C(=O)[O-])N)C(=O)O.[Na+]

Isomeric SMILES

CCC1C2N(C1=O)C(=C(S2)SCC(C(=O)[O-])N)C(=O)O.[Na+]

InChI

InChI=1S/C11H14N2O5S2.Na/c1-2-4-7(14)13-6(10(17)18)11(20-8(4)13)19-3-5(12)9(15)16;/h4-5,8H,2-3,12H2,1H3,(H,15,16)(H,17,18);/q;+1/p-1