2-(4-bromanyl-2,3,5-trimethyl-phenoxy)ethyl-(2-hydroxyethyl)azanium

Systemtic Name: 2-(4-bromanyl-2,3,5-trimethyl-phenoxy)ethyl-(2-hydroxyethyl)azanium Openeye Name: 2-(4-bromo-2,3,5-trimethyl-phenoxy)ethyl-(2-hydroxyethyl)ammonium CAS Name: 2-(4-bromo-2,3,5-trimethylphenoxy)ethyl-(2-hydroxyethyl)ammonium IUPAC Name: 2-(4-bromo-2,3,5-trimethylphenoxy)ethyl-(2-hydroxyethyl)azanium Traditional Name: 2-(4-bromo-2,3,5-trimethyl-phenoxy)ethyl-(2-hydroxyethyl)ammonium Formula: C13H21BrNO2+ MolecularWeight: 303.21534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Br)C)C)OCC[NH2+]CCO

Isomeric SMILES

CC1=CC(=C(C(=C1Br)C)C)OCC[NH2+]CCO

InChI

InChI=1S/C13H20BrNO2/c1-9-8-12(10(2)11(3)13(9)14)17-7-5-15-4-6-16/h8,15-16H,4-7H2,1-3H3/p+1