1-hexyl-4-(phenylmethyl)pyridin-1-ium; tetraphenylboranuide

Systemtic Name: 1-hexyl-4-(phenylmethyl)pyridin-1-ium; tetraphenylboranuide Openeye Name: 4-benzyl-1-hexyl-pyridin-1-ium; tetraphenylboranuide CAS Name: 1-hexyl-4-(phenylmethyl)pyridin-1-ium; tetraphenylboranuide IUPAC Name: 4-benzyl-1-hexylpyridin-1-ium; tetraphenylboranuide Traditional Name: 4-benzyl-1-hexyl-pyridin-1-ium; tetraphenylboranuide Formula: C42H44BN MolecularWeight: 573.61646

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CCCCCC[N+]1=CC=C(C=C1)CC2=CC=CC=C2

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CCCCCC[N+]1=CC=C(C=C1)CC2=CC=CC=C2

InChI

InChI=1S/C24H20B.C18H24N/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;1-2-3-4-8-13-19-14-11-18(12-15-19)16-17-9-6-5-7-10-17/h1-20H;5-7,9-12,14-15H,2-4,8,13,16H2,1H3/q-1;+1