(5-bromanyl-2-methoxy-phenyl)methyl-(2-hydroxyethyl)-propyl-azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-(2-hydroxyethyl)-propyl-azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-(2-hydroxyethyl)-propyl-ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-(2-hydroxyethyl)-propylammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-(2-hydroxyethyl)-propylazanium Traditional Name: (5-bromo-2-methoxy-benzyl)-(2-hydroxyethyl)-propyl-ammonium Formula: C13H21BrNO2+ MolecularWeight: 303.21534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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