4-ethyl-1-hexadecyl-pyridin-1-ium; tetrakis(4-methylphenyl)boranuide

Systemtic Name: 4-ethyl-1-hexadecyl-pyridin-1-ium; tetrakis(4-methylphenyl)boranuide Openeye Name: 4-ethyl-1-hexadecyl-pyridin-1-ium; tetrakis-p-tolylboranuide CAS Name: 4-ethyl-1-hexadecylpyridin-1-ium; tetrakis(4-methylphenyl)boranuide IUPAC Name: 4-ethyl-1-hexadecylpyridin-1-ium; tetrakis(4-methylphenyl)boranuide Traditional Name: 1-cetyl-4-ethyl-pyridin-1-ium; tetrakis-p-tolylboranuide Formula: C51H70BN MolecularWeight: 707.9192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28B.C23H42N/c1-21-5-13-25(14-6-21)29(26-15-7-22(2)8-16-26,27-17-9-23(3)10-18-27)28-19-11-24(4)12-20-28;1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-24-21-18-23(4-2)19-22-24/h5-20H,1-4H3;18-19,21-22H,3-17,20H2,1-2H3/q-1;+1