5-(4-fluorophenyl)-3-oxidanyl-1,5-dihydro-2,4,3-benzodioxaborepine-8-carboxylic acid

Systemtic Name: 5-(4-fluorophenyl)-3-oxidanyl-1,5-dihydro-2,4,3-benzodioxaborepine-8-carboxylic acid Openeye Name: 5-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2,4,3-benzodioxaborepine-8-carboxylic acid CAS Name: 5-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2,4,3-benzodioxaborepin-8-carboxylic acid IUPAC Name: 5-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2,4,3-benzodioxaborepine-8-carboxylic acid Traditional Name: 5-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2,4,3-benzodioxaborepin-8-carboxylic acid Formula: C15H12BFO5 MolecularWeight: 302.062183

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC2=C(C=CC(=C2)C(=O)O)C(O1)C3=CC=C(C=C3)F)O

Isomeric SMILES

B1(OCC2=C(C=CC(=C2)C(=O)O)C(O1)C3=CC=C(C=C3)F)O

InChI

InChI=1S/C15H12BFO5/c17-12-4-1-9(2-5-12)14-13-6-3-10(15(18)19)7-11(13)8-21-16(20)22-14/h1-7,14,20H,8H2,(H,18,19)