(3-bromanyl-4-fluoranyl-phenyl)methyl-(2-hydroxyethyl)-propyl-azanium

Systemtic Name: (3-bromanyl-4-fluoranyl-phenyl)methyl-(2-hydroxyethyl)-propyl-azanium Openeye Name: (3-bromo-4-fluoro-phenyl)methyl-(2-hydroxyethyl)-propyl-ammonium CAS Name: (3-bromo-4-fluorophenyl)methyl-(2-hydroxyethyl)-propylammonium IUPAC Name: (3-bromo-4-fluorophenyl)methyl-(2-hydroxyethyl)-propylazanium Traditional Name: (3-bromo-4-fluoro-benzyl)-(2-hydroxyethyl)-propyl-ammonium Formula: C12H18BrFNO+ MolecularWeight: 291.179823

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCO)CC1=CC(=C(C=C1)F)Br

Isomeric SMILES

CCC[NH+](CCO)CC1=CC(=C(C=C1)F)Br

InChI

InChI=1S/C12H17BrFNO/c1-2-5-15(6-7-16)9-10-3-4-12(14)11(13)8-10/h3-4,8,16H,2,5-7,9H2,1H3/p+1