2-[3-[2-(1-adamantyl)ethyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol bromide

Systemtic Name: 2-[3-[2-(1-adamantyl)ethyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol bromide Openeye Name: 2-[3-[2-(1-adamantyl)ethyl]-4-methyl-thiazol-3-ium-5-yl]ethanol bromide CAS Name: 2-[3-[2-(1-adamantyl)ethyl]-4-methyl-5-thiazol-3-iumyl]ethanol bromide IUPAC Name: 2-[3-[2-(1-adamantyl)ethyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol bromide Traditional Name: 2-[3-[2-(1-adamantyl)ethyl]-4-methyl-thiazol-3-ium-5-yl]ethanol bromide Formula: C18H28BrNOS MolecularWeight: 386.39002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CCC23CC4CC(C2)CC(C4)C3)CCO.[Br-]

Isomeric SMILES

CC1=C(SC=[N+]1CCC23CC4CC(C2)CC(C4)C3)CCO.[Br-]

InChI

InChI=1S/C18H28NOS.BrH/c1-13-17(2-5-20)21-12-19(13)4-3-18-9-14-6-15(10-18)8-16(7-14)11-18;/h12,14-16,20H,2-11H2,1H3;1H/q+1;/p-1