butyl-tris(4-methylphenyl)boranuide; 1-octylquinolin-1-ium

Systemtic Name: butyl-tris(4-methylphenyl)boranuide; 1-octylquinolin-1-ium Openeye Name: butyl(tris-p-tolyl)boranuide; 1-octylquinolin-1-ium CAS Name: butyl-tris(4-methylphenyl)boranuide; 1-octylquinolin-1-ium IUPAC Name: butyl-tris(4-methylphenyl)boranuide; 1-octylquinolin-1-ium Traditional Name: butyl(tris-p-tolyl)boranuide; 1-octylquinolin-1-ium Formula: C42H54BN MolecularWeight: 583.69586

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Descriptors Computed from Structure

Canonical SMILES:

[B-](CCCC)(C1=CC=C(C=C1)C)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.CCCCCCCC[N+]1=CC=CC2=CC=CC=C21

Isomeric SMILES

[B-](CCCC)(C1=CC=C(C=C1)C)(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.CCCCCCCC[N+]1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C25H30B.C17H24N/c1-5-6-19-26(23-13-7-20(2)8-14-23,24-15-9-21(3)10-16-24)25-17-11-22(4)12-18-25;1-2-3-4-5-6-9-14-18-15-10-12-16-11-7-8-13-17(16)18/h7-18H,5-6,19H2,1-4H3;7-8,10-13,15H,2-6,9,14H2,1H3/q-1;+1