(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-[2-(dimethylazaniumyl)ethyl]-methyl-azanium

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)methyl-[2-(dimethylazaniumyl)ethyl]-methyl-azanium Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)methyl-[2-(dimethylammonio)ethyl]-methyl-ammonium CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)methyl-[2-(dimethylammonio)ethyl]-methylammonium IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)methyl-[2-(dimethylazaniumyl)ethyl]-methylazanium Traditional Name: (3,5-ditert-butyl-4-hydroxy-benzyl)-[2-(dimethylammonio)ethyl]-methyl-ammonium Formula: C20H38N2O+2 MolecularWeight: 322.52852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[NH+](C)CC[NH+](C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C[NH+](C)CC[NH+](C)C

InChI

InChI=1S/C20H36N2O/c1-19(2,3)16-12-15(14-22(9)11-10-21(7)8)13-17(18(16)23)20(4,5)6/h12-13,23H,10-11,14H2,1-9H3/p+2