tetraphenylboranuide; 2-(2-undecyl-1H-imidazol-3-ium-3-yl)propanenitrile

Systemtic Name: tetraphenylboranuide; 2-(2-undecyl-1H-imidazol-3-ium-3-yl)propanenitrile Openeye Name: tetraphenylboranuide; 2-(2-undecyl-1H-imidazol-3-ium-3-yl)propanenitrile CAS Name: tetraphenylboranuide; 2-(2-undecyl-1H-imidazol-3-ium-3-yl)propanenitrile IUPAC Name: tetraphenylboranuide; 2-(2-undecyl-1H-imidazol-3-ium-3-yl)propanenitrile Traditional Name: tetraphenylboranuide; 2-(2-undecyl-1H-imidazol-3-ium-3-yl)propionitrile Formula: C41H50BN3 MolecularWeight: 595.6668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CCCCCCCCCCCC1=[N+](C=CN1)C(C)C#N

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CCCCCCCCCCCC1=[N+](C=CN1)C(C)C#N

InChI

InChI=1S/C24H20B.C17H29N3/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-3-4-5-6-7-8-9-10-11-12-17-19-13-14-20(17)16(2)15-18/h1-20H;13-14,16H,3-12H2,1-2H3/q-1;/p+1