sodium 3-methylidene-8-oxidanylidene-7-[2-(1,2,3,4-tetrazol-1-yl)ethanoylamino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate

Systemtic Name: sodium 3-methylidene-8-oxidanylidene-7-[2-(1,2,3,4-tetrazol-1-yl)ethanoylamino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: sodium 3-methylene-8-oxo-7-[[2-(tetrazol-1-yl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: sodium 3-methylene-8-oxo-7-[[1-oxo-2-(1-tetrazolyl)ethyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate IUPAC Name: sodium 3-methylidene-8-oxo-7-[[2-(tetrazol-1-yl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: sodium 8-keto-3-methylene-7-[[2-(tetrazol-1-yl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Formula: C11H11N6NaO4S MolecularWeight: 346.29761

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CSC2C(C(=O)N2C1C(=O)[O-])NC(=O)CN3C=NN=N3.[Na+]

Isomeric SMILES

C=C1CSC2C(C(=O)N2C1C(=O)[O-])NC(=O)CN3C=NN=N3.[Na+]

InChI

InChI=1S/C11H12N6O4S.Na/c1-5-3-22-10-7(9(19)17(10)8(5)11(20)21)13-6(18)2-16-4-12-14-15-16;/h4,7-8,10H,1-3H2,(H,13,18)(H,20,21);/q;+1/p-1