(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-trimethyl-azanium; methyl sulfate

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-trimethyl-azanium; methyl sulfate Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)methyl-trimethyl-ammonium; methyl sulfate CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)methyl-trimethylammonium; methyl sulfate IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)methyl-trimethylazanium; methyl sulfate Traditional Name: (3,5-ditert-butyl-4-hydroxy-benzyl)-trimethyl-ammonium; methyl sulfate Formula: C19H35NO5S MolecularWeight: 389.5499

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[N+](C)(C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[N+](C)(C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C18H31NO.CH4O4S/c1-17(2,3)14-10-13(12-19(7,8)9)11-15(16(14)20)18(4,5)6;1-5-6(2,3)4/h10-11H,12H2,1-9H3;1H3,(H,2,3,4)