2-[[5-(butoxymethyl)-1-benzofuran-2-yl]carbonyloxy]ethyl-diethyl-methyl-azanium

Systemtic Name: 2-[[5-(butoxymethyl)-1-benzofuran-2-yl]carbonyloxy]ethyl-diethyl-methyl-azanium Openeye Name: 2-[5-(butoxymethyl)benzofuran-2-carbonyl]oxyethyl-diethyl-methyl-ammonium CAS Name: 2-[[5-(butoxymethyl)-2-benzofuranyl]-oxomethoxy]ethyl-diethyl-methylammonium IUPAC Name: 2-[5-(butoxymethyl)-1-benzofuran-2-carbonyl]oxyethyl-diethyl-methylazanium Traditional Name: 2-[5-(butoxymethyl)benzofuran-2-carbonyl]oxyethyl-diethyl-methyl-ammonium Formula: C21H32NO4+ MolecularWeight: 362.48308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC1=CC2=C(C=C1)OC(=C2)C(=O)OCC[N+](C)(CC)CC

Isomeric SMILES

CCCCOCC1=CC2=C(C=C1)OC(=C2)C(=O)OCC[N+](C)(CC)CC

InChI

InChI=1S/C21H32NO4/c1-5-8-12-24-16-17-9-10-19-18(14-17)15-20(26-19)21(23)25-13-11-22(4,6-2)7-3/h9-10,14-15H,5-8,11-13,16H2,1-4H3/q+1