(diphenylmethyl) (6R,7R)-7-azanyl-8-oxidanylidene-3-(pyrrolidin-1-ylcarbonyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) (6R,7R)-7-azanyl-8-oxidanylidene-3-(pyrrolidin-1-ylcarbonyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl (6R,7R)-7-amino-8-oxo-3-(pyrrolidine-1-carbonyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: (6R,7R)-7-amino-8-oxo-3-[[oxo(1-pyrrolidinyl)methoxy]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (6R,7R)-7-amino-8-oxo-3-(pyrrolidine-1-carbonyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: (6R,7R)-7-amino-8-keto-3-(pyrrolidine-1-carbonyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C26H27N3O5S MolecularWeight: 493.57468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)OCC2=C(N3C(C(C3=O)N)SC2)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)OCC2=C(N3[C@@H]([C@@H](C3=O)N)SC2)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H27N3O5S/c27-20-23(30)29-21(19(16-35-24(20)29)15-33-26(32)28-13-7-8-14-28)25(31)34-22(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-6,9-12,20,22,24H,7-8,13-16,27H2/t20-,24-/m1/s1