3-(4-bromanyl-2,3-dimethyl-phenoxy)propyl-(2-hydroxyethyl)azanium

Systemtic Name: 3-(4-bromanyl-2,3-dimethyl-phenoxy)propyl-(2-hydroxyethyl)azanium Openeye Name: 3-(4-bromo-2,3-dimethyl-phenoxy)propyl-(2-hydroxyethyl)ammonium CAS Name: 3-(4-bromo-2,3-dimethylphenoxy)propyl-(2-hydroxyethyl)ammonium IUPAC Name: 3-(4-bromo-2,3-dimethylphenoxy)propyl-(2-hydroxyethyl)azanium Traditional Name: 3-(4-bromo-2,3-dimethyl-phenoxy)propyl-(2-hydroxyethyl)ammonium Formula: C13H21BrNO2+ MolecularWeight: 303.21534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Br)OCCC[NH2+]CCO

Isomeric SMILES

CC1=C(C=CC(=C1C)Br)OCCC[NH2+]CCO

InChI

InChI=1S/C13H20BrNO2/c1-10-11(2)13(5-4-12(10)14)17-9-3-6-15-7-8-16/h4-5,15-16H,3,6-9H2,1-2H3/p+1