3-(furan-2-yl)-5-[(4-phenylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(furan-2-yl)-5-[(4-phenylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(2-furyl)-5-[(4-phenylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-(2-furanyl)-5-[(4-phenyl-1-piperidin-1-iumyl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(furan-2-yl)-5-[(4-phenylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(2-furyl)-5-[(4-phenylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Formula: C18H20N3O2+ MolecularWeight: 310.3703

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CO4

Isomeric SMILES

C1C[NH+](CCC1C2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CO4

InChI

InChI=1S/C18H19N3O2/c1-2-5-14(6-3-1)15-8-10-21(11-9-15)13-17-19-18(20-23-17)16-7-4-12-22-16/h1-7,12,15H,8-11,13H2/p+1