[1,2-bis(oxidanyl)-1-phenyl-hexan-3-yl]carbamoylboron

Systemtic Name: [1,2-bis(oxidanyl)-1-phenyl-hexan-3-yl]carbamoylboron Openeye Name: 1-(1,2-dihydroxy-2-phenyl-ethyl)butylcarbamoylboron CAS Name: [[(1,2-dihydroxy-1-phenylhexan-3-yl)amino]-oxomethyl]boron IUPAC Name: (1,2-dihydroxy-1-phenylhexan-3-yl)carbamoylboron Traditional Name: 1-(1,2-dihydroxy-2-phenyl-ethyl)butylcarbamoylboron Formula: C13H18BNO3 MolecularWeight: 247.09792

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)NC(CCC)C(C(C1=CC=CC=C1)O)O

Isomeric SMILES

[B]C(=O)NC(CCC)C(C(C1=CC=CC=C1)O)O

InChI

InChI=1S/C13H18BNO3/c1-2-6-10(15-13(14)18)12(17)11(16)9-7-4-3-5-8-9/h3-5,7-8,10-12,16-17H,2,6H2,1H3,(H,15,18)