sodium 3-[(E)-2-acetamidoethenyl]sulfanyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium 3-[(E)-2-acetamidoethenyl]sulfanyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium 3-[(E)-2-acetamidovinyl]sulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium 3-[[(E)-2-acetamidoethenyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium 3-[(E)-2-acetamidoethenyl]sulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium 3-[[(E)-2-acetamidovinyl]thio]-7-keto-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C11H11N2NaO4S MolecularWeight: 290.27081

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC=CSC1=C(N2C(C1)CC2=O)C(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)N/C=C/SC1=C(N2C(C1)CC2=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C11H12N2O4S.Na/c1-6(14)12-2-3-18-8-4-7-5-9(15)13(7)10(8)11(16)17;/h2-3,7H,4-5H2,1H3,(H,12,14)(H,16,17);/q;+1/p-1/b3-2+;