3-[(4-chlorophenyl)methyl]-5-(3-piperidin-1-ium-1-ylpropyl)-1,2,4-oxadiazole

Systemtic Name: 3-[(4-chlorophenyl)methyl]-5-(3-piperidin-1-ium-1-ylpropyl)-1,2,4-oxadiazole Openeye Name: 3-[(4-chlorophenyl)methyl]-5-(3-piperidin-1-ium-1-ylpropyl)-1,2,4-oxadiazole CAS Name: 3-[(4-chlorophenyl)methyl]-5-[3-(1-piperidin-1-iumyl)propyl]-1,2,4-oxadiazole IUPAC Name: 3-[(4-chlorophenyl)methyl]-5-(3-piperidin-1-ium-1-ylpropyl)-1,2,4-oxadiazole Traditional Name: 3-(4-chlorobenzyl)-5-(3-piperidin-1-ium-1-ylpropyl)-1,2,4-oxadiazole Formula: C17H23ClN3O+ MolecularWeight: 320.83702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCC2=NC(=NO2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCCC2=NC(=NO2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H22ClN3O/c18-15-8-6-14(7-9-15)13-16-19-17(22-20-16)5-4-12-21-10-2-1-3-11-21/h6-9H,1-5,10-13H2/p+1