sodium 7-oxidanylidene-6-(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium 7-oxidanylidene-6-(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium 6-benzyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium 7-oxo-6-(phenylmethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium 6-benzyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium 6-benzyl-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C13H10NNaO3S MolecularWeight: 283.27817

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C3N(C2=O)C(=CS3)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CC2C3N(C2=O)C(=CS3)C(=O)[O-].[Na+]

InChI

InChI=1S/C13H11NO3S.Na/c15-11-9(6-8-4-2-1-3-5-8)12-14(11)10(7-18-12)13(16)17;/h1-5,7,9,12H,6H2,(H,16,17);/q;+1/p-1