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

Systemtic Name: (diphenylmethyl) 7-formamido-3-(hydroxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 7-formamido-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-formamido-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-formamido-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-formamido-8-keto-3-methylol-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C22H20N2O5S MolecularWeight: 424.4696

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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)CO

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O5S/c25-11-16-12-30-21-17(23-13-26)20(27)24(21)18(16)22(28)29-19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,13,17,19,21,25H,11-12H2,(H,23,26)