(diphenylmethyl) 7-formamido-3-oxidanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate

Systemtic Name: (diphenylmethyl) 7-formamido-3-oxidanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: benzhydryl 7-formamido-3-hydroxy-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: 7-formamido-3-hydroxy-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-formamido-3-hydroxy-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: 7-formamido-3-hydroxy-8-keto-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid benzhydryl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N2C(S1)C(C2=O)NC=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

C1C(C(N2C(S1)C(C2=O)NC=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C21H20N2O5S/c24-12-22-16-19(26)23-17(15(25)11-29-20(16)23)21(27)28-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,12,15-18,20,25H,11H2,(H,22,24)