3-(3-hexadecoxy-2-methoxy-propyl)-1,3-thiazol-3-ium iodide

Systemtic Name: 3-(3-hexadecoxy-2-methoxy-propyl)-1,3-thiazol-3-ium iodide Openeye Name: 3-(3-hexadecoxy-2-methoxy-propyl)thiazol-3-ium iodide CAS Name: 3-(3-hexadecoxy-2-methoxypropyl)thiazol-3-ium iodide IUPAC Name: 3-(3-hexadecoxy-2-methoxypropyl)-1,3-thiazol-3-ium iodide Traditional Name: 3-(3-cetyloxy-2-methoxy-propyl)thiazol-3-ium iodide Formula: C23H44INO2S MolecularWeight: 525.57043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(C[N+]1=CSC=C1)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(C[N+]1=CSC=C1)OC.[I-]

InChI

InChI=1S/C23H44NO2S.HI/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-26-21-23(25-2)20-24-17-19-27-22-24;/h17,19,22-23H,3-16,18,20-21H2,1-2H3;1H/q+1;/p-1