(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-hexadecyl-dimethyl-azanium

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-hexadecyl-dimethyl-azanium Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)methyl-hexadecyl-dimethyl-ammonium CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)methyl-hexadecyl-dimethylammonium IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)methyl-hexadecyl-dimethylazanium Traditional Name: cetyl-(3,5-ditert-butyl-4-hydroxy-benzyl)-dimethyl-ammonium Formula: C33H62NO+ MolecularWeight: 488.85148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C33H61NO/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-34(8,9)27-28-25-29(32(2,3)4)31(35)30(26-28)33(5,6)7/h25-26H,10-24,27H2,1-9H3/p+1