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

Systemtic Name: cyclobutyl-phenyl-[5-[1-(phenylmethyl)piperidin-1-ium-1-yl]-1,2,4-oxadiazol-3-yl]methanol Openeye Name: [5-(1-benzylpiperidin-1-ium-1-yl)-1,2,4-oxadiazol-3-yl]-cyclobutyl-phenyl-methanol CAS Name: cyclobutyl-phenyl-[5-[1-(phenylmethyl)-1-piperidin-1-iumyl]-1,2,4-oxadiazol-3-yl]methanol IUPAC Name: [5-(1-benzylpiperidin-1-ium-1-yl)-1,2,4-oxadiazol-3-yl]-cyclobutyl-phenylmethanol Traditional Name: [5-(1-benzylpiperidin-1-ium-1-yl)-1,2,4-oxadiazol-3-yl]-cyclobutyl-phenyl-methanol Formula: C25H30N3O2+ MolecularWeight: 404.5246

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(CC2=CC=CC=C2)C3=NC(=NO3)C(C4CCC4)(C5=CC=CC=C5)O

Isomeric SMILES

C1CC[N+](CC1)(CC2=CC=CC=C2)C3=NC(=NO3)C(C4CCC4)(C5=CC=CC=C5)O

InChI

InChI=1S/C25H30N3O2/c29-25(22-15-10-16-22,21-13-6-2-7-14-21)23-26-24(30-27-23)28(17-8-3-9-18-28)19-20-11-4-1-5-12-20/h1-2,4-7,11-14,22,29H,3,8-10,15-19H2/q+1