[2-(diphenylmethyl)oxycarbonyl-3-methanoyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-3-en-7-yl]carbamoylboron

Systemtic Name: [2-(diphenylmethyl)oxycarbonyl-3-methanoyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-3-en-7-yl]carbamoylboron Openeye Name: (2-benzhydryloxycarbonyl-3-formyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-en-7-yl)carbamoylboron CAS Name: [[[2-[(diphenylmethyl)oxy-oxomethyl]-3-formyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-en-7-yl]amino]-oxomethyl]boron IUPAC Name: (2-benzhydryloxycarbonyl-3-formyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-3-en-7-yl)carbamoylboron Traditional Name: (2-benzhydryloxycarbonyl-3-formyl-8-keto-5-thia-1-azabicyclo[4.2.0]oct-3-en-7-yl)carbamoylboron Formula: C22H17BN2O5S MolecularWeight: 432.25678

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)NC1C2N(C1=O)C(C(=CS2)C=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

[B]C(=O)NC1C2N(C1=O)C(C(=CS2)C=O)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H17BN2O5S/c23-22(29)24-16-19(27)25-17(15(11-26)12-31-20(16)25)21(28)30-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12,16-18,20H,(H,24,29)