(diphenylmethyl) 3-diphenylphosphoryloxy-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 3-diphenylphosphoryloxy-8-oxidanylidene-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 3-diphenylphosphoryloxy-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-diphenylphosphoryloxy-8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 3-diphenylphosphoryloxy-8-oxo-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-diphenylphosphoryloxy-8-keto-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C40H33N2O7PS MolecularWeight: 716.737981

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)OP(=O)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)OP(=O)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C40H33N2O7PS/c43-34(26-47-30-20-10-3-11-21-30)41-35-38(44)42-36(40(45)48-37(28-16-6-1-7-17-28)29-18-8-2-9-19-29)33(27-51-39(35)42)49-50(46,31-22-12-4-13-23-31)32-24-14-5-15-25-32/h1-25,35,37,39H,26-27H2,(H,41,43)