[[2-(methylsulfonylamino)-3-(4-methylsulfonyloxy-3-oxidanyl-phenyl)propanoyl]amino]boron

Systemtic Name: [[2-(methylsulfonylamino)-3-(4-methylsulfonyloxy-3-oxidanyl-phenyl)propanoyl]amino]boron Openeye Name: [[3-(3-hydroxy-4-methylsulfonyloxy-phenyl)-2-(methanesulfonamido)propanoyl]amino]boron CAS Name: [[3-(3-hydroxy-4-methylsulfonyloxyphenyl)-2-(methanesulfonamido)-1-oxopropyl]amino]boron IUPAC Name: [[3-(3-hydroxy-4-methylsulfonyloxyphenyl)-2-(methanesulfonamido)propanoyl]amino]boron Traditional Name: [[3-(3-hydroxy-4-methylsulfonyloxy-phenyl)-2-(methanesulfonamido)propanoyl]amino]boron Formula: C11H15BN2O7S2 MolecularWeight: 362.187

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Descriptors Computed from Structure

Canonical SMILES:

[B]NC(=O)C(CC1=CC(=C(C=C1)OS(=O)(=O)C)O)NS(=O)(=O)C

Isomeric SMILES

[B]NC(=O)C(CC1=CC(=C(C=C1)OS(=O)(=O)C)O)NS(=O)(=O)C

InChI

InChI=1S/C11H15BN2O7S2/c1-22(17,18)14-8(11(16)13-12)5-7-3-4-10(9(15)6-7)21-23(2,19)20/h3-4,6,8,14-15H,5H2,1-2H3,(H,13,16)