4-[2-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-4-yl]ethyl]phenol

Systemtic Name: 4-[2-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-4-yl]ethyl]phenol Openeye Name: 4-[2-[1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-yl]ethyl]phenol CAS Name: 4-[2-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-4-piperidin-1-iumyl]ethyl]phenol IUPAC Name: 4-[2-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-4-yl]ethyl]phenol Traditional Name: 4-[2-[1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-yl]ethyl]phenol Formula: C20H24N3O2S+ MolecularWeight: 370.48846

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC2=CC=C(C=C2)O)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CCC1CCC2=CC=C(C=C2)O)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C20H23N3O2S/c24-17-7-5-15(6-8-17)3-4-16-9-11-23(12-10-16)14-19-21-20(22-25-19)18-2-1-13-26-18/h1-2,5-8,13,16,24H,3-4,9-12,14H2/p+1