5-[[2,2-bis(prop-2-enyl)piperidin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[2,2-bis(prop-2-enyl)piperidin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-[(2,2-diallylpiperidin-1-ium-1-yl)methyl]-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[2,2-bis(prop-2-enyl)-1-piperidin-1-iumyl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[[2,2-bis(prop-2-enyl)piperidin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-[(2,2-diallylpiperidin-1-ium-1-yl)methyl]-3-(2-thienyl)-1,2,4-oxadiazole Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(CCCC[NH+]1CC2=NC(=NO2)C3=CC=CS3)CC=C

Isomeric SMILES

C=CCC1(CCCC[NH+]1CC2=NC(=NO2)C3=CC=CS3)CC=C

InChI

InChI=1S/C18H23N3OS/c1-3-9-18(10-4-2)11-5-6-12-21(18)14-16-19-17(20-22-16)15-8-7-13-23-15/h3-4,7-8,13H,1-2,5-6,9-12,14H2/p+1