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

Systemtic Name: 12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol Openeye Name: 12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol CAS Name: 12-[[4-(1-methyl-3-pyridin-1-iumyl)-1,2,5-thiadiazol-3-yl]oxy]-1-dodecanol IUPAC Name: 12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol Traditional Name: 12-[[4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazol-3-yl]oxy]dodecan-1-ol Formula: C20H32N3O2S+ MolecularWeight: 378.55198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32N3O2S/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/q+1