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

Systemtic Name: phenyl-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: phenyl-[1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-yl]methanone CAS Name: phenyl-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: phenyl-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: phenyl-[1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-yl]methanone Formula: C19H20N3O2S+ MolecularWeight: 354.446

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)C2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CCC1C(=O)C2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C19H19N3O2S/c23-18(14-5-2-1-3-6-14)15-8-10-22(11-9-15)13-17-20-19(21-24-17)16-7-4-12-25-16/h1-7,12,15H,8-11,13H2/p+1