sodium (E)-4-(2-carboxy-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)but-3-enoate

Systemtic Name: sodium (E)-4-(2-carboxy-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)but-3-enoate Openeye Name: sodium (E)-4-(2-carboxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)but-3-enoate CAS Name: sodium (E)-4-(2-carboxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)-3-butenoate IUPAC Name: sodium (E)-4-(2-carboxy-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)but-3-enoate Traditional Name: sodium (E)-4-(2-carboxy-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-en-3-yl)but-3-enoate Formula: C10H8NNaO5S MolecularWeight: 277.22899

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO5S.Na/c12-6-4-7-11(6)9(10(15)16)5(17-7)2-1-3-8(13)14;/h1-2,7H,3-4H2,(H,13,14)(H,15,16);/q;+1/p-1/b2-1+;