[1-[1,2-bis(oxidanyl)-4-oxidanylidene-nonadecan-3-yl]oxy-3-oxidanyl-propan-2-yl]oxyboronic acid

Systemtic Name: [1-[1,2-bis(oxidanyl)-4-oxidanylidene-nonadecan-3-yl]oxy-3-oxidanyl-propan-2-yl]oxyboronic acid Openeye Name: [1-[[1-(1,2-dihydroxyethyl)-2-oxo-heptadecoxy]methyl]-2-hydroxy-ethoxy]boronic acid CAS Name: [1-(1,2-dihydroxy-4-oxononadecan-3-yl)oxy-3-hydroxypropan-2-yl]oxyboronic acid IUPAC Name: [1-(1,2-dihydroxy-4-oxononadecan-3-yl)oxy-3-hydroxypropan-2-yl]oxyboronic acid Traditional Name: [1-[[1-(1,2-dihydroxyethyl)-2-keto-heptadecoxy]methyl]-2-hydroxy-ethoxy]boronic acid Formula: C22H45BO8 MolecularWeight: 448.3989

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Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)OC(CO)COC(C(CO)O)C(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

B(O)(O)OC(CO)COC(C(CO)O)C(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C22H45BO8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(26)22(21(27)17-25)30-18-19(16-24)31-23(28)29/h19,21-22,24-25,27-29H,2-18H2,1H3