disodium 3-(2-carboxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: disodium 3-(2-carboxyethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: disodium 3-(2-carboxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: disodium 3-(2-carboxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: disodium 3-(2-carboxyethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: disodium 3-(2-carboxyethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C18H16N2Na2O10S2 MolecularWeight: 530.43658

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(=C(S2)CCC(=O)O)C(=O)[O-].C1C2N(C1=O)C(=C(S2)CCC(=O)O)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1C2N(C1=O)C(=C(S2)CCC(=O)O)C(=O)[O-].C1C2N(C1=O)C(=C(S2)CCC(=O)O)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/2C9H9NO5S.2Na/c2*11-5-3-6-10(5)8(9(14)15)4(16-6)1-2-7(12)13;;/h2*6H,1-3H2,(H,12,13)(H,14,15);;/q;;2*+1/p-2