1-benzofuran-2-ylmethyl-[6-(dimethylazaniumyl)hexyl]-ethyl-azanium

Systemtic Name: 1-benzofuran-2-ylmethyl-[6-(dimethylazaniumyl)hexyl]-ethyl-azanium Openeye Name: benzofuran-2-ylmethyl-[6-(dimethylammonio)hexyl]-ethyl-ammonium CAS Name: 2-benzofuranylmethyl-[6-(dimethylammonio)hexyl]-ethylammonium IUPAC Name: 1-benzofuran-2-ylmethyl-[6-(dimethylazaniumyl)hexyl]-ethylazanium Traditional Name: benzofuran-2-ylmethyl-[6-(dimethylammonio)hexyl]-ethyl-ammonium Formula: C19H32N2O+2 MolecularWeight: 304.47018

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCCCC[NH+](C)C)CC1=CC2=CC=CC=C2O1

Isomeric SMILES

CC[NH+](CCCCCC[NH+](C)C)CC1=CC2=CC=CC=C2O1

InChI

InChI=1S/C19H30N2O/c1-4-21(14-10-6-5-9-13-20(2)3)16-18-15-17-11-7-8-12-19(17)22-18/h7-8,11-12,15H,4-6,9-10,13-14,16H2,1-3H3/p+2