1-phenyl-1-[5-[1-(phenylmethyl)piperidin-1-ium-1-yl]-1,2,4-oxadiazol-3-yl]pentan-1-ol

Systemtic Name: 1-phenyl-1-[5-[1-(phenylmethyl)piperidin-1-ium-1-yl]-1,2,4-oxadiazol-3-yl]pentan-1-ol Openeye Name: 1-[5-(1-benzylpiperidin-1-ium-1-yl)-1,2,4-oxadiazol-3-yl]-1-phenyl-pentan-1-ol CAS Name: 1-phenyl-1-[5-[1-(phenylmethyl)-1-piperidin-1-iumyl]-1,2,4-oxadiazol-3-yl]-1-pentanol IUPAC Name: 1-[5-(1-benzylpiperidin-1-ium-1-yl)-1,2,4-oxadiazol-3-yl]-1-phenylpentan-1-ol Traditional Name: 1-[5-(1-benzylpiperidin-1-ium-1-yl)-1,2,4-oxadiazol-3-yl]-1-phenyl-pentan-1-ol Formula: C25H32N3O2+ MolecularWeight: 406.54048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1)(C2=NOC(=N2)[N+]3(CCCCC3)CC4=CC=CC=C4)O

Isomeric SMILES

CCCCC(C1=CC=CC=C1)(C2=NOC(=N2)[N+]3(CCCCC3)CC4=CC=CC=C4)O

InChI

InChI=1S/C25H32N3O2/c1-2-3-17-25(29,22-15-9-5-10-16-22)23-26-24(30-27-23)28(18-11-6-12-19-28)20-21-13-7-4-8-14-21/h4-5,7-10,13-16,29H,2-3,6,11-12,17-20H2,1H3/q+1