1-benzofuran-2-yl-[4-(3-bromanylpropoxy)-3-methyl-morpholin-4-ium-4-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[4-(3-bromanylpropoxy)-3-methyl-morpholin-4-ium-4-yl]methanone Openeye Name: benzofuran-2-yl-[4-(3-bromopropoxy)-3-methyl-morpholin-4-ium-4-yl]methanone CAS Name: 2-benzofuranyl-[4-(3-bromopropoxy)-3-methyl-4-morpholin-4-iumyl]methanone IUPAC Name: 1-benzofuran-2-yl-[4-(3-bromopropoxy)-3-methylmorpholin-4-ium-4-yl]methanone Traditional Name: benzofuran-2-yl-[4-(3-bromopropoxy)-3-methyl-morpholin-4-ium-4-yl]methanone Formula: C17H21BrNO4+ MolecularWeight: 383.25694

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCC[N+]1(C(=O)C2=CC3=CC=CC=C3O2)OCCCBr

Isomeric SMILES

CC1COCC[N+]1(C(=O)C2=CC3=CC=CC=C3O2)OCCCBr

InChI

InChI=1S/C17H21BrNO4/c1-13-12-21-10-8-19(13,22-9-4-7-18)17(20)16-11-14-5-2-3-6-15(14)23-16/h2-3,5-6,11,13H,4,7-10,12H2,1H3/q+1