(4-tetradecyloxolan-2-yl)methyl 6-(1,3-thiazol-3-ium-3-yl)hexanoate

Systemtic Name: (4-tetradecyloxolan-2-yl)methyl 6-(1,3-thiazol-3-ium-3-yl)hexanoate Openeye Name: (4-tetradecyltetrahydrofuran-2-yl)methyl 6-thiazol-3-ium-3-ylhexanoate CAS Name: 6-(3-thiazol-3-iumyl)hexanoic acid (4-tetradecyl-2-oxolanyl)methyl ester IUPAC Name: (4-tetradecyloxolan-2-yl)methyl 6-(1,3-thiazol-3-ium-3-yl)hexanoate Traditional Name: 6-thiazol-3-ium-3-ylhexanoic acid (4-myristyltetrahydrofuran-2-yl)methyl ester Formula: C28H50NO3S+ MolecularWeight: 480.7665

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1CC(OC1)COC(=O)CCCCC[N+]2=CSC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC1CC(OC1)COC(=O)CCCCC[N+]2=CSC=C2

InChI

InChI=1S/C28H50NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-26-22-27(31-23-26)24-32-28(30)18-15-13-16-19-29-20-21-33-25-29/h20-21,25-27H,2-19,22-24H2,1H3/q+1