(5-bromanyl-2-oxidanyl-phenyl)methyl-(2-hydroxyethyl)azanium

Systemtic Name: (5-bromanyl-2-oxidanyl-phenyl)methyl-(2-hydroxyethyl)azanium Openeye Name: (5-bromo-2-hydroxy-phenyl)methyl-(2-hydroxyethyl)ammonium CAS Name: (5-bromo-2-hydroxyphenyl)methyl-(2-hydroxyethyl)ammonium IUPAC Name: (5-bromo-2-hydroxyphenyl)methyl-(2-hydroxyethyl)azanium Traditional Name: (5-bromo-2-hydroxy-benzyl)-(2-hydroxyethyl)ammonium Formula: C9H13BrNO2+ MolecularWeight: 247.10902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C[NH2+]CCO)O

Isomeric SMILES

C1=CC(=C(C=C1Br)C[NH2+]CCO)O

InChI

InChI=1S/C9H12BrNO2/c10-8-1-2-9(13)7(5-8)6-11-3-4-12/h1-2,5,11-13H,3-4,6H2/p+1