(4-tetradecyloxolan-2-yl)methyl N-[5-(1,3-thiazol-3-ium-3-yl)pentyl]carbamate

Systemtic Name: (4-tetradecyloxolan-2-yl)methyl N-[5-(1,3-thiazol-3-ium-3-yl)pentyl]carbamate Openeye Name: (4-tetradecyltetrahydrofuran-2-yl)methyl N-(5-thiazol-3-ium-3-ylpentyl)carbamate CAS Name: N-[5-(3-thiazol-3-iumyl)pentyl]carbamic acid (4-tetradecyl-2-oxolanyl)methyl ester IUPAC Name: (4-tetradecyloxolan-2-yl)methyl N-[5-(1,3-thiazol-3-ium-3-yl)pentyl]carbamate Traditional Name: N-(5-thiazol-3-ium-3-ylpentyl)carbamic acid (4-myristyltetrahydrofuran-2-yl)methyl ester Formula: C28H51N2O3S+ MolecularWeight: 495.78114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H50N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-26-22-27(32-23-26)24-33-28(31)29-18-15-13-16-19-30-20-21-34-25-30/h20-21,25-27H,2-19,22-24H2,1H3/p+1