nonyl 2-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]ethanoate chloride

Systemtic Name: nonyl 2-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]ethanoate chloride Openeye Name: nonyl 2-[5-(2-hydroxyethyl)-4-methyl-thiazol-3-ium-3-yl]acetate chloride CAS Name: 2-[5-(2-hydroxyethyl)-4-methyl-3-thiazol-3-iumyl]acetic acid nonyl ester chloride IUPAC Name: nonyl 2-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]acetate chloride Traditional Name: 2-[5-(2-hydroxyethyl)-4-methyl-thiazol-3-ium-3-yl]acetic acid nonyl ester chloride Formula: C17H30ClNO3S MolecularWeight: 363.943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C[N+]1=CSC(=C1C)CCO.[Cl-]

Isomeric SMILES

CCCCCCCCCOC(=O)C[N+]1=CSC(=C1C)CCO.[Cl-]

InChI

InChI=1S/C17H30NO3S.ClH/c1-3-4-5-6-7-8-9-12-21-17(20)13-18-14-22-16(10-11-19)15(18)2;/h14,19H,3-13H2,1-2H3;1H/q+1;/p-1