sodium 7-oxidanylidene-3-(phenylmethoxymethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium 7-oxidanylidene-3-(phenylmethoxymethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium 3-(benzyloxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium 7-oxo-3-(phenylmethoxymethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium 7-oxo-3-(phenylmethoxymethyl)-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium 3-(benzoxymethyl)-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C14H12NNaO4S MolecularWeight: 313.30415

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(=C(S2)COCC3=CC=CC=C3)C(=O)[O-].[Na+]

Isomeric SMILES

C1C2N(C1=O)C(=C(S2)COCC3=CC=CC=C3)C(=O)[O-].[Na+]

InChI

InChI=1S/C14H13NO4S.Na/c16-11-6-12-15(11)13(14(17)18)10(20-12)8-19-7-9-4-2-1-3-5-9;/h1-5,12H,6-8H2,(H,17,18);/q;+1/p-1