(5-bromanyl-2-ethoxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium

Systemtic Name: (5-bromanyl-2-ethoxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium Openeye Name: (5-bromo-2-ethoxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]ammonium CAS Name: (5-bromo-2-ethoxyphenyl)methyl-[2-(2-hydroxyethylamino)ethyl]ammonium IUPAC Name: (5-bromo-2-ethoxyphenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium Traditional Name: (5-bromo-2-ethoxy-benzyl)-[2-(2-hydroxyethylamino)ethyl]ammonium Formula: C13H22BrN2O2+ MolecularWeight: 318.22998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C[NH2+]CCNCCO

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C[NH2+]CCNCCO

InChI

InChI=1S/C13H21BrN2O2/c1-2-18-13-4-3-12(14)9-11(13)10-16-6-5-15-7-8-17/h3-4,9,15-17H,2,5-8,10H2,1H3/p+1