N-[1-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-1-ium-4-yl]benzenesulfonamide

Systemtic Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-1-ium-4-yl]benzenesulfonamide Openeye Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-1-ium-4-yl]benzenesulfonamide CAS Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-4-piperidin-1-iumyl]benzenesulfonamide IUPAC Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-1-ium-4-yl]benzenesulfonamide Traditional Name: N-[1-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-1-ium-4-yl]benzenesulfonamide Formula: C21H25N4O4S+ MolecularWeight: 429.5126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(O2)C[NH+]3CCC(CC3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(O2)C[NH+]3CCC(CC3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O4S/c1-28-18-9-7-16(8-10-18)21-23-22-20(29-21)15-25-13-11-17(12-14-25)24-30(26,27)19-5-3-2-4-6-19/h2-10,17,24H,11-15H2,1H3/p+1