(5-bromanyl-2,4-dimethoxy-phenyl)methyl-bis(2-hydroxyethyl)azanium

Systemtic Name: (5-bromanyl-2,4-dimethoxy-phenyl)methyl-bis(2-hydroxyethyl)azanium Openeye Name: (5-bromo-2,4-dimethoxy-phenyl)methyl-bis(2-hydroxyethyl)ammonium CAS Name: (5-bromo-2,4-dimethoxyphenyl)methyl-bis(2-hydroxyethyl)ammonium IUPAC Name: (5-bromo-2,4-dimethoxyphenyl)methyl-bis(2-hydroxyethyl)azanium Traditional Name: (5-bromo-2,4-dimethoxy-benzyl)-bis(2-hydroxyethyl)ammonium Formula: C13H21BrNO4+ MolecularWeight: 335.21414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH+](CCO)CCO)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH+](CCO)CCO)Br)OC

InChI

InChI=1S/C13H20BrNO4/c1-18-12-8-13(19-2)11(14)7-10(12)9-15(3-5-16)4-6-17/h7-8,16-17H,3-6,9H2,1-2H3/p+1