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

Systemtic Name: (5-bromanyl-2-ethoxy-phenyl)methyl-[2-(2-hydroxyethyloxy)ethyl]azanium Openeye Name: (5-bromo-2-ethoxy-phenyl)methyl-[2-(2-hydroxyethoxy)ethyl]ammonium CAS Name: (5-bromo-2-ethoxyphenyl)methyl-[2-(2-hydroxyethoxy)ethyl]ammonium IUPAC Name: (5-bromo-2-ethoxyphenyl)methyl-[2-(2-hydroxyethoxy)ethyl]azanium Traditional Name: (5-bromo-2-ethoxy-benzyl)-[2-(2-hydroxyethoxy)ethyl]ammonium Formula: C13H21BrNO3+ MolecularWeight: 319.21474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20BrNO3/c1-2-18-13-4-3-12(14)9-11(13)10-15-5-7-17-8-6-16/h3-4,9,15-16H,2,5-8,10H2,1H3/p+1