2-[1-(1,3-dioxolan-2-ylmethyl)piperidin-1-ium-4-yl]-1H-benzimidazole

Systemtic Name: 2-[1-(1,3-dioxolan-2-ylmethyl)piperidin-1-ium-4-yl]-1H-benzimidazole Openeye Name: 2-[1-(1,3-dioxolan-2-ylmethyl)piperidin-1-ium-4-yl]-1H-benzimidazole CAS Name: 2-[1-(1,3-dioxolan-2-ylmethyl)-4-piperidin-1-iumyl]-1H-benzimidazole IUPAC Name: 2-[1-(1,3-dioxolan-2-ylmethyl)piperidin-1-ium-4-yl]-1H-benzimidazole Traditional Name: 2-[1-(1,3-dioxolan-2-ylmethyl)piperidin-1-ium-4-yl]-1H-benzimidazole Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=NC3=CC=CC=C3N2)CC4OCCO4

Isomeric SMILES

C1C[NH+](CCC1C2=NC3=CC=CC=C3N2)CC4OCCO4

InChI

InChI=1S/C16H21N3O2/c1-2-4-14-13(3-1)17-16(18-14)12-5-7-19(8-6-12)11-15-20-9-10-21-15/h1-4,12,15H,5-11H2,(H,17,18)/p+1