3-phenyl-5-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-phenyl-5-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 5-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 3-phenyl-5-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 5-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[(4-benzylpiperidin-1-ium-1-yl)methyl]-3-phenyl-1,2,4-oxadiazole Formula: C21H24N3O+ MolecularWeight: 334.43476

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N3O/c1-3-7-17(8-4-1)15-18-11-13-24(14-12-18)16-20-22-21(23-25-20)19-9-5-2-6-10-19/h1-10,18H,11-16H2/p+1