2-(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonyloxyethyl-bis[(2-methylphenyl)methyl]azanium; tetraphenylboranuide

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonyloxyethyl-bis[(2-methylphenyl)methyl]azanium; tetraphenylboranuide Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-benzoyl)oxyethyl-bis(o-tolylmethyl)ammonium; tetraphenylboranuide CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)-oxomethoxy]ethyl-bis[(2-methylphenyl)methyl]ammonium; tetraphenylboranuide IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxybenzoyl)oxyethyl-bis[(2-methylphenyl)methyl]azanium; tetraphenylboranuide Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-benzoyl)oxyethyl-bis(2-methylbenzyl)ammonium; tetraphenylboranuide Formula: C57H64BNO3 MolecularWeight: 821.93396

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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=CC=C1C[NH+](CCOC(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)CC3=CC=CC=C3C

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1=CC=CC=C1C[NH+](CCOC(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)CC3=CC=CC=C3C

InChI

InChI=1S/C33H43NO3.C24H20B/c1-23-13-9-11-15-25(23)21-34(22-26-16-12-10-14-24(26)2)17-18-37-31(36)27-19-28(32(3,4)5)30(35)29(20-27)33(6,7)8;1-5-13-21(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/h9-16,19-20,35H,17-18,21-22H2,1-8H3;1-20H/q;-1/p+1