2-(4-methyl-3-phenethyl-1,3-thiazol-3-ium-5-yl)ethanol iodide

Systemtic Name: 2-(4-methyl-3-phenethyl-1,3-thiazol-3-ium-5-yl)ethanol iodide Openeye Name: 2-(4-methyl-3-phenethyl-thiazol-3-ium-5-yl)ethanol iodide CAS Name: 2-(4-methyl-3-phenethyl-5-thiazol-3-iumyl)ethanol iodide IUPAC Name: 2-(4-methyl-3-phenethyl-1,3-thiazol-3-ium-5-yl)ethanol iodide Traditional Name: 2-(4-methyl-3-phenethyl-thiazol-3-ium-5-yl)ethanol iodide Formula: C14H18INOS MolecularWeight: 375.26829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CCC2=CC=CC=C2)CCO.[I-]

Isomeric SMILES

CC1=C(SC=[N+]1CCC2=CC=CC=C2)CCO.[I-]

InChI

InChI=1S/C14H18NOS.HI/c1-12-14(8-10-16)17-11-15(12)9-7-13-5-3-2-4-6-13;/h2-6,11,16H,7-10H2,1H3;1H/q+1;/p-1