(3-bromanyl-4,5-dimethoxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium

Systemtic Name: (3-bromanyl-4,5-dimethoxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium Openeye Name: (3-bromo-4,5-dimethoxy-phenyl)methyl-[2-(2-hydroxyethylamino)ethyl]ammonium CAS Name: (3-bromo-4,5-dimethoxyphenyl)methyl-[2-(2-hydroxyethylamino)ethyl]ammonium IUPAC Name: (3-bromo-4,5-dimethoxyphenyl)methyl-[2-(2-hydroxyethylamino)ethyl]azanium Traditional Name: (3-bromo-4,5-dimethoxy-benzyl)-[2-(2-hydroxyethylamino)ethyl]ammonium Formula: C13H22BrN2O3+ MolecularWeight: 334.22938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CCNCCO)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CCNCCO)Br)OC

InChI

InChI=1S/C13H21BrN2O3/c1-18-12-8-10(7-11(14)13(12)19-2)9-16-4-3-15-5-6-17/h7-8,15-17H,3-6,9H2,1-2H3/p+1