12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol iodide

Systemtic Name: 12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol iodide Openeye Name: 12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol iodide CAS Name: 12-[[4-(1-methyl-3-pyridin-1-iumyl)-1,2,5-thiadiazol-3-yl]oxy]-1-dodecanol iodide IUPAC Name: 12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol iodide Traditional Name: 12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol iodide Formula: C20H32IN3O2S MolecularWeight: 505.45645

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C2=NSN=C2OCCCCCCCCCCCCO.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C2=NSN=C2OCCCCCCCCCCCCO.[I-]

InChI

InChI=1S/C20H32N3O2S.HI/c1-23-14-12-13-18(17-23)19-20(22-26-21-19)25-16-11-9-7-5-3-2-4-6-8-10-15-24;/h12-14,17,24H,2-11,15-16H2,1H3;1H/q+1;/p-1