4-[(E)-2-ethyl-4-(2-oxidanyl-5-pent-1-en-2-yl-3,6-dihydro-1,2-oxaborinin-6-yl)but-1-enyl]-2-fluoranyl-phenol

Systemtic Name: 4-[(E)-2-ethyl-4-(2-oxidanyl-5-pent-1-en-2-yl-3,6-dihydro-1,2-oxaborinin-6-yl)but-1-enyl]-2-fluoranyl-phenol Openeye Name: 4-[(E)-2-ethyl-4-[2-hydroxy-5-(1-methylenebutyl)-3,6-dihydrooxaborinin-6-yl]but-1-enyl]-2-fluoro-phenol CAS Name: 4-[(E)-2-ethyl-4-(2-hydroxy-5-pent-1-en-2-yl-3,6-dihydrooxaborin-6-yl)but-1-enyl]-2-fluorophenol IUPAC Name: 4-[(E)-2-ethyl-4-(2-hydroxy-5-pent-1-en-2-yl-3,6-dihydrooxaborinin-6-yl)but-1-enyl]-2-fluorophenol Traditional Name: 4-[(E)-2-ethyl-4-[2-hydroxy-5-(1-propylvinyl)-3,6-dihydrooxaborin-6-yl]but-1-enyl]-2-fluoro-phenol Formula: C21H28BFO3 MolecularWeight: 358.254623

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Descriptors Computed from Structure

Canonical SMILES:

B1(CC=C(C(O1)CCC(=CC2=CC(=C(C=C2)O)F)CC)C(=C)CCC)O

Isomeric SMILES

B1(CC=C(C(O1)CC/C(=C/C2=CC(=C(C=C2)O)F)/CC)C(=C)CCC)O

InChI

InChI=1S/C21H28BFO3/c1-4-6-15(3)18-11-12-22(25)26-21(18)10-8-16(5-2)13-17-7-9-20(24)19(23)14-17/h7,9,11,13-14,21,24-25H,3-6,8,10,12H2,1-2H3/b16-13+