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

Systemtic Name: (2-methyl-1,3-dioxolan-4-yl)methyl 6-(1,3-thiazol-3-ium-3-yl)hexanoate Openeye Name: (2-methyl-1,3-dioxolan-4-yl)methyl 6-thiazol-3-ium-3-ylhexanoate CAS Name: 6-(3-thiazol-3-iumyl)hexanoic acid (2-methyl-1,3-dioxolan-4-yl)methyl ester IUPAC Name: (2-methyl-1,3-dioxolan-4-yl)methyl 6-(1,3-thiazol-3-ium-3-yl)hexanoate Traditional Name: 6-thiazol-3-ium-3-ylhexanoic acid (2-methyl-1,3-dioxolan-4-yl)methyl ester Formula: C14H22NO4S+ MolecularWeight: 300.39378

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Descriptors Computed from Structure

Canonical SMILES:

CC1OCC(O1)COC(=O)CCCCC[N+]2=CSC=C2

Isomeric SMILES

CC1OCC(O1)COC(=O)CCCCC[N+]2=CSC=C2

InChI

InChI=1S/C14H22NO4S/c1-12-17-9-13(19-12)10-18-14(16)5-3-2-4-6-15-7-8-20-11-15/h7-8,11-13H,2-6,9-10H2,1H3/q+1