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

Systemtic Name: nonyl 2-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]ethanoate Openeye Name: nonyl 2-[5-(2-hydroxyethyl)-4-methyl-thiazol-3-ium-3-yl]acetate CAS Name: 2-[5-(2-hydroxyethyl)-4-methyl-3-thiazol-3-iumyl]acetic acid nonyl ester IUPAC Name: nonyl 2-[5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium-3-yl]acetate Traditional Name: 2-[5-(2-hydroxyethyl)-4-methyl-thiazol-3-ium-3-yl]acetic acid nonyl ester Formula: C17H30NO3S+ MolecularWeight: 328.49

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30NO3S/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/q+1