butanoyloxy(1,1,2-triphenylbutoxy)borinate; 2-hydroxyethyl(trimethyl)azanium

Systemtic Name: butanoyloxy(1,1,2-triphenylbutoxy)borinate; 2-hydroxyethyl(trimethyl)azanium Openeye Name: butanoyloxy(1,1,2-triphenylbutoxy)borinate; 2-hydroxyethyl(trimethyl)ammonium CAS Name: 2-hydroxyethyl(trimethyl)ammonium; 1-oxobutoxy(1,1,2-triphenylbutoxy)borinate IUPAC Name: butanoyloxy(1,1,2-triphenylbutoxy)borinate; 2-hydroxyethyl(trimethyl)azanium Traditional Name: butyryloxy(1,1,2-triphenylbutoxy)borinate; 2-hydroxyethyl(trimethyl)ammonium Formula: C31H42BNO5 MolecularWeight: 519.47988

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Descriptors Computed from Structure

Canonical SMILES:

B([O-])(OC(=O)CCC)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C(CC)C3=CC=CC=C3.C[N+](C)(C)CCO

Isomeric SMILES

B([O-])(OC(=O)CCC)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C(CC)C3=CC=CC=C3.C[N+](C)(C)CCO

InChI

InChI=1S/C26H28BO4.C5H14NO/c1-3-14-25(28)30-27(29)31-26(22-17-10-6-11-18-22,23-19-12-7-13-20-23)24(4-2)21-15-8-5-9-16-21;1-6(2,3)4-5-7/h5-13,15-20,24H,3-4,14H2,1-2H3;7H,4-5H2,1-3H3/q-1;+1