methyl 3-[2-(oxidanylideneboranylmethylideneamino)ethanoylamino]-2-(phenylsulfonylamino)propanoate

Systemtic Name: methyl 3-[2-(oxidanylideneboranylmethylideneamino)ethanoylamino]-2-(phenylsulfonylamino)propanoate Openeye Name: methyl 2-(benzenesulfonamido)-3-[[2-(oxoboranylmethyleneamino)acetyl]amino]propanoate CAS Name: 2-(benzenesulfonamido)-3-[[1-oxo-2-(oxoboranylmethylideneamino)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-(benzenesulfonamido)-3-[[2-(oxoboranylmethylideneamino)acetyl]amino]propanoate Traditional Name: 2-(benzenesulfonamido)-3-[[2-(ketoboranylmethyleneamino)acetyl]amino]propionic acid methyl ester Formula: C13H16BN3O6S MolecularWeight: 353.15864

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Descriptors Computed from Structure

Canonical SMILES:

B(=O)C=NCC(=O)NCC(C(=O)OC)NS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

B(=O)C=NCC(=O)NCC(C(=O)OC)NS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H16BN3O6S/c1-23-13(19)11(7-16-12(18)8-15-9-14-20)17-24(21,22)10-5-3-2-4-6-10/h2-6,9,11,17H,7-8H2,1H3,(H,16,18)