3-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]-2-oxidanyl-propane-1-sulfonic acid

Systemtic Name: 3-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]-2-oxidanyl-propane-1-sulfonic acid Openeye Name: 3-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]-2-hydroxy-propane-1-sulfonic acid CAS Name: 3-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]-2-hydroxy-1-propanesulfonic acid IUPAC Name: 3-[2-heptadecyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]-2-hydroxypropane-1-sulfonic acid Traditional Name: 3-[2-heptadecyl-1-(2-hydroxyethyl)-2-imidazolin-1-ium-1-yl]-2-hydroxy-propane-1-sulfonic acid Formula: C25H51N2O5S+ MolecularWeight: 491.74784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC(CS(=O)(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC(CS(=O)(=O)O)O

InChI

InChI=1S/C25H50N2O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25-26-18-19-27(25,20-21-28)22-24(29)23-33(30,31)32/h24,28-29H,2-23H2,1H3/p+1