sodium (5R,6Z)-6-(3-methylbutylidene)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium (5R,6Z)-6-(3-methylbutylidene)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium (5R,6Z)-6-(3-methylbutylidene)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium (5R,6Z)-6-(3-methylbutylidene)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium (5R,6Z)-6-(3-methylbutylidene)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium (5R,6Z)-7-keto-6-(3-methylbutylidene)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C11H12NNaO3S MolecularWeight: 261.27265

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC=C1C2N(C1=O)C(=CS2)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)C/C=C/1\[C@@H]2N(C1=O)C(=CS2)C(=O)[O-].[Na+]

InChI

InChI=1S/C11H13NO3S.Na/c1-6(2)3-4-7-9(13)12-8(11(14)15)5-16-10(7)12;/h4-6,10H,3H2,1-2H3,(H,14,15);/q;+1/p-1/b7-4-;/t10-;/m1./s1