2-[(5-bromanyl-6-methoxy-3-methyl-1-benzofuran-2-yl)carbonyloxy]ethyl-diethyl-azanium chloride

Systemtic Name: 2-[(5-bromanyl-6-methoxy-3-methyl-1-benzofuran-2-yl)carbonyloxy]ethyl-diethyl-azanium chloride Openeye Name: 2-(5-bromo-6-methoxy-3-methyl-benzofuran-2-carbonyl)oxyethyl-diethyl-ammonium chloride CAS Name: 2-[(5-bromo-6-methoxy-3-methyl-2-benzofuranyl)-oxomethoxy]ethyl-diethylammonium chloride IUPAC Name: 2-(5-bromo-6-methoxy-3-methyl-1-benzofuran-2-carbonyl)oxyethyl-diethylazanium chloride Traditional Name: 2-(5-bromo-6-methoxy-3-methyl-benzofuran-2-carbonyl)oxyethyl-diethyl-ammonium chloride Formula: C17H23BrClNO4 MolecularWeight: 420.72582

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC(=O)C1=C(C2=CC(=C(C=C2O1)OC)Br)C.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCOC(=O)C1=C(C2=CC(=C(C=C2O1)OC)Br)C.[Cl-]

InChI

InChI=1S/C17H22BrNO4.ClH/c1-5-19(6-2)7-8-22-17(20)16-11(3)12-9-13(18)15(21-4)10-14(12)23-16;/h9-10H,5-8H2,1-4H3;1H