[3-fluoranyl-4-[2-(11-oxidanylundecylsulfanyl)ethanoyl]phenyl]boronic acid

Systemtic Name: [3-fluoranyl-4-[2-(11-oxidanylundecylsulfanyl)ethanoyl]phenyl]boronic acid Openeye Name: [3-fluoro-4-[2-(11-hydroxyundecylsulfanyl)acetyl]phenyl]boronic acid CAS Name: [3-fluoro-4-[2-(11-hydroxyundecylthio)-1-oxoethyl]phenyl]boronic acid IUPAC Name: [3-fluoro-4-[2-(11-hydroxyundecylsulfanyl)acetyl]phenyl]boronic acid Traditional Name: [3-fluoro-4-[2-(11-hydroxyundecylthio)acetyl]phenyl]boronic acid Formula: C19H30BFO4S MolecularWeight: 384.313503

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=C(C=C1)C(=O)CSCCCCCCCCCCCO)F)(O)O

Isomeric SMILES

B(C1=CC(=C(C=C1)C(=O)CSCCCCCCCCCCCO)F)(O)O

InChI

InChI=1S/C19H30BFO4S/c21-18-14-16(20(24)25)10-11-17(18)19(23)15-26-13-9-7-5-3-1-2-4-6-8-12-22/h10-11,14,22,24-25H,1-9,12-13,15H2