1-benzofuran-2-ylmethyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]azanium

Systemtic Name: 1-benzofuran-2-ylmethyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]azanium Openeye Name: benzofuran-2-ylmethyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ammonium CAS Name: 2-benzofuranylmethyl-[3-(4-methyl-1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: 1-benzofuran-2-ylmethyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]azanium Traditional Name: benzofuran-2-ylmethyl-[3-(4-methylpiperidin-1-ium-1-yl)propyl]ammonium Formula: C18H28N2O+2 MolecularWeight: 288.42772

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCC[NH2+]CC2=CC3=CC=CC=C3O2

Isomeric SMILES

CC1CC[NH+](CC1)CCC[NH2+]CC2=CC3=CC=CC=C3O2

InChI

InChI=1S/C18H26N2O/c1-15-7-11-20(12-8-15)10-4-9-19-14-17-13-16-5-2-3-6-18(16)21-17/h2-3,5-6,13,15,19H,4,7-12,14H2,1H3/p+2