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

Systemtic Name: 3-phenyl-5-[(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-phenyl-5-[(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-phenyl-5-[[4-(1-piperidin-1-iumyl)-1-piperidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-phenyl-5-[(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-phenyl-5-[(4-piperidin-1-ium-1-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Formula: C19H28N4O+2 MolecularWeight: 328.45182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)C2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C19H26N4O/c1-3-7-16(8-4-1)19-20-18(24-21-19)15-22-13-9-17(10-14-22)23-11-5-2-6-12-23/h1,3-4,7-8,17H,2,5-6,9-15H2/p+2