(4-pentylphenyl) 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzoate

Systemtic Name: (4-pentylphenyl) 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzoate Openeye Name: (4-pentylphenyl) 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzoate CAS Name: 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzoic acid (4-pentylphenyl) ester IUPAC Name: (4-pentylphenyl) 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzoate Traditional Name: 4-(5-propyl-1,3,2-dioxaborinan-2-yl)benzoic acid (4-amylphenyl) ester Formula: C24H31BO4 MolecularWeight: 394.31154

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)CCC)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC

Isomeric SMILES

B1(OCC(CO1)CCC)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C24H31BO4/c1-3-5-6-8-19-9-15-23(16-10-19)29-24(26)21-11-13-22(14-12-21)25-27-17-20(7-4-2)18-28-25/h9-16,20H,3-8,17-18H2,1-2H3