[3-methyl-1-oxidanidyl-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-1-ium-2-yl] 2-methoxypropanoate

Systemtic Name: [3-methyl-1-oxidanidyl-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-1-ium-2-yl] 2-methoxypropanoate Openeye Name: [3-methyl-1-oxido-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-1-ium-2-yl] 2-methoxypropanoate CAS Name: 2-methoxypropanoic acid [3-methyl-1-oxido-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2-imidazolidin-1-iumyl] ester IUPAC Name: [3-methyl-1-oxido-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-1-ium-2-yl] 2-methoxypropanoate Traditional Name: 2-methoxypropionic acid [3-methyl-1-oxido-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-1-ium-2-yl] ester Formula: C11H15F3N4O4S MolecularWeight: 356.32141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1N(CC[N+]1(C2=NN=C(S2)C(F)(F)F)[O-])C)OC

Isomeric SMILES

CC(C(=O)OC1N(CC[N+]1(C2=NN=C(S2)C(F)(F)F)[O-])C)OC

InChI

InChI=1S/C11H15F3N4O4S/c1-6(21-3)7(19)22-10-17(2)4-5-18(10,20)9-16-15-8(23-9)11(12,13)14/h6,10H,4-5H2,1-3H3