2-azanylethyl-(3-bromanyl-5-tert-butyl-2-oxidanyl-phenyl)-methyl-propyl-azanium

Systemtic Name: 2-azanylethyl-(3-bromanyl-5-tert-butyl-2-oxidanyl-phenyl)-methyl-propyl-azanium Openeye Name: 2-aminoethyl-(3-bromo-5-tert-butyl-2-hydroxy-phenyl)-methyl-propyl-ammonium CAS Name: 2-aminoethyl-(3-bromo-5-tert-butyl-2-hydroxyphenyl)-methyl-propylammonium IUPAC Name: 2-aminoethyl-(3-bromo-5-tert-butyl-2-hydroxyphenyl)-methyl-propylazanium Traditional Name: 2-aminoethyl-(3-bromo-5-tert-butyl-2-hydroxy-phenyl)-methyl-propyl-ammonium Formula: C16H28BrN2O+ MolecularWeight: 344.31032

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(CCN)C1=C(C(=CC(=C1)C(C)(C)C)Br)O

Isomeric SMILES

CCC[N+](C)(CCN)C1=C(C(=CC(=C1)C(C)(C)C)Br)O

InChI

InChI=1S/C16H27BrN2O/c1-6-8-19(5,9-7-18)14-11-12(16(2,3)4)10-13(17)15(14)20/h10-11H,6-9,18H2,1-5H3/p+1