3-(1-hexadecoxypropan-2-yl)-1,3-thiazol-3-ium

Systemtic Name: 3-(1-hexadecoxypropan-2-yl)-1,3-thiazol-3-ium Openeye Name: 3-(2-hexadecoxy-1-methyl-ethyl)thiazol-3-ium CAS Name: 3-(1-hexadecoxypropan-2-yl)thiazol-3-ium IUPAC Name: 3-(1-hexadecoxypropan-2-yl)-1,3-thiazol-3-ium Traditional Name: 3-(2-cetyloxy-1-methyl-ethyl)thiazol-3-ium Formula: C22H42NOS+ MolecularWeight: 368.63998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H42NOS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-24-20-22(2)23-17-19-25-21-23/h17,19,21-22H,3-16,18,20H2,1-2H3/q+1