dimethyl-(4-methylphenyl)-[[4-(phenylcarbonyl)phenyl]methyl]azanium; tetraphenylboranuide

Systemtic Name: dimethyl-(4-methylphenyl)-[[4-(phenylcarbonyl)phenyl]methyl]azanium; tetraphenylboranuide Openeye Name: (4-benzoylphenyl)methyl-dimethyl-(p-tolyl)ammonium; tetraphenylboranuide CAS Name: (4-benzoylphenyl)methyl-dimethyl-(4-methylphenyl)ammonium; tetraphenylboranuide IUPAC Name: (4-benzoylphenyl)methyl-dimethyl-(4-methylphenyl)azanium; tetraphenylboranuide Traditional Name: (4-benzoylbenzyl)-dimethyl-(p-tolyl)ammonium; tetraphenylboranuide Formula: C47H44BNO MolecularWeight: 649.66936

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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.CC1=CC=C(C=C1)[N+](C)(C)CC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1=CC=C(C=C1)[N+](C)(C)CC2=CC=C(C=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H20B.C23H24NO/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;1-18-9-15-22(16-10-18)24(2,3)17-19-11-13-21(14-12-19)23(25)20-7-5-4-6-8-20/h1-20H;4-16H,17H2,1-3H3/q-1;+1