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

Systemtic Name: 3-(3-hexadecoxy-2-methoxy-propyl)-1,3-thiazol-3-ium Openeye Name: 3-(3-hexadecoxy-2-methoxy-propyl)thiazol-3-ium CAS Name: 3-(3-hexadecoxy-2-methoxypropyl)thiazol-3-ium IUPAC Name: 3-(3-hexadecoxy-2-methoxypropyl)-1,3-thiazol-3-ium Traditional Name: 3-(3-cetyloxy-2-methoxy-propyl)thiazol-3-ium Formula: C23H44NO2S+ MolecularWeight: 398.66596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H44NO2S/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/q+1