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

Systemtic Name: sodium 7-oxidanylidene-6-(2-phenylethanoylamino)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium 7-oxo-6-[(2-phenylacetyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium 7-oxo-6-[(1-oxo-2-phenylethyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium 7-oxo-6-[(2-phenylacetyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium 7-keto-6-[(2-phenylacetyl)amino]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C15H13N2NaO4 MolecularWeight: 308.26449

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N2C1C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-].[Na+]

Isomeric SMILES

C1C=C(N2C1C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)[O-].[Na+]

InChI

InChI=1S/C15H14N2O4.Na/c18-12(8-9-4-2-1-3-5-9)16-13-10-6-7-11(15(20)21)17(10)14(13)19;/h1-5,7,10,13H,6,8H2,(H,16,18)(H,20,21);/q;+1/p-1