[3,6-bis(oxidanyl)-6-oxidanylidene-1-phenyl-4-phenylmethoxy-5-(phenylmethyl)hexan-2-yl]carbamoylboron

Systemtic Name: [3,6-bis(oxidanyl)-6-oxidanylidene-1-phenyl-4-phenylmethoxy-5-(phenylmethyl)hexan-2-yl]carbamoylboron Openeye Name: (1,4-dibenzyl-3-benzyloxy-2,5-dihydroxy-5-oxo-pentyl)carbamoylboron CAS Name: [[[3,6-dihydroxy-6-oxo-1-phenyl-4-phenylmethoxy-5-(phenylmethyl)hexan-2-yl]amino]-oxomethyl]boron IUPAC Name: (5-benzyl-3,6-dihydroxy-6-oxo-1-phenyl-4-phenylmethoxyhexan-2-yl)carbamoylboron Traditional Name: (3-benzoxy-1,4-dibenzyl-2,5-dihydroxy-5-keto-pentyl)carbamoylboron Formula: C27H28BNO5 MolecularWeight: 457.32592

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)NC(CC1=CC=CC=C1)C(C(C(CC2=CC=CC=C2)C(=O)O)OCC3=CC=CC=C3)O

Isomeric SMILES

[B]C(=O)NC(CC1=CC=CC=C1)C(C(C(CC2=CC=CC=C2)C(=O)O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C27H28BNO5/c28-27(33)29-23(17-20-12-6-2-7-13-20)24(30)25(34-18-21-14-8-3-9-15-21)22(26(31)32)16-19-10-4-1-5-11-19/h1-15,22-25,30H,16-18H2,(H,29,33)(H,31,32)