2-(4-fluorophenyl)-4-pentyl-1,3,2-dioxaboretane-4-carboxylic acid

Systemtic Name: 2-(4-fluorophenyl)-4-pentyl-1,3,2-dioxaboretane-4-carboxylic acid Openeye Name: 2-(4-fluorophenyl)-4-pentyl-1,3,2-dioxaboretane-4-carboxylic acid CAS Name: 2-(4-fluorophenyl)-4-pentyl-1,3,2-dioxaboretane-4-carboxylic acid IUPAC Name: 2-(4-fluorophenyl)-4-pentyl-1,3,2-dioxaboretane-4-carboxylic acid Traditional Name: 4-amyl-2-(4-fluorophenyl)-1,3,2-dioxaboretane-4-carboxylic acid Formula: C13H16BFO4 MolecularWeight: 266.073143

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC(O1)(CCCCC)C(=O)O)C2=CC=C(C=C2)F

Isomeric SMILES

B1(OC(O1)(CCCCC)C(=O)O)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H16BFO4/c1-2-3-4-9-13(12(16)17)18-14(19-13)10-5-7-11(15)8-6-10/h5-8H,2-4,9H2,1H3,(H,16,17)