2-[[5,7-bis(bromanyl)-6-methoxy-3-methyl-1-benzofuran-2-yl]carbonyloxy]ethyl-diethyl-azanium

Systemtic Name: 2-[[5,7-bis(bromanyl)-6-methoxy-3-methyl-1-benzofuran-2-yl]carbonyloxy]ethyl-diethyl-azanium Openeye Name: 2-(5,7-dibromo-6-methoxy-3-methyl-benzofuran-2-carbonyl)oxyethyl-diethyl-ammonium CAS Name: 2-[(5,7-dibromo-6-methoxy-3-methyl-2-benzofuranyl)-oxomethoxy]ethyl-diethylammonium IUPAC Name: 2-(5,7-dibromo-6-methoxy-3-methyl-1-benzofuran-2-carbonyl)oxyethyl-diethylazanium Traditional Name: 2-(5,7-dibromo-6-methoxy-3-methyl-benzofuran-2-carbonyl)oxyethyl-diethyl-ammonium Formula: C17H22Br2NO4+ MolecularWeight: 464.16888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21Br2NO4/c1-5-20(6-2)7-8-23-17(21)14-10(3)11-9-12(18)16(22-4)13(19)15(11)24-14/h9H,5-8H2,1-4H3/p+1