3-diphenylphosphoryl-6-(1-hydroxyethyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: 3-diphenylphosphoryl-6-(1-hydroxyethyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: 3-diphenylphosphoryl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 3-diphenylphosphoryl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: 3-diphenylphosphoryl-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 3-diphenylphosphoryl-6-(1-hydroxyethyl)-7-keto-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C21H19NO5P- MolecularWeight: 396.353021

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2CC(=C(N2C1=O)C(=O)[O-])P(=O)(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CC(C1C2CC(=C(N2C1=O)C(=O)[O-])P(=O)(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C21H20NO5P/c1-13(23)18-16-12-17(19(21(25)26)22(16)20(18)24)28(27,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,16,18,23H,12H2,1H3,(H,25,26)/p-1