1-benzofuran-2-ylmethyl-[9-(dimethylazaniumyl)nonyl]-methyl-azanium

Systemtic Name: 1-benzofuran-2-ylmethyl-[9-(dimethylazaniumyl)nonyl]-methyl-azanium Openeye Name: benzofuran-2-ylmethyl-[9-(dimethylammonio)nonyl]-methyl-ammonium CAS Name: 2-benzofuranylmethyl-[9-(dimethylammonio)nonyl]-methylammonium IUPAC Name: 1-benzofuran-2-ylmethyl-[9-(dimethylazaniumyl)nonyl]-methylazanium Traditional Name: benzofuran-2-ylmethyl-[9-(dimethylammonio)nonyl]-methyl-ammonium Formula: C21H36N2O+2 MolecularWeight: 332.52334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2O/c1-22(2)15-11-7-5-4-6-8-12-16-23(3)18-20-17-19-13-9-10-14-21(19)24-20/h9-10,13-14,17H,4-8,11-12,15-16,18H2,1-3H3/p+2