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

Systemtic Name: [1-methyl-3-oxidanidyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-yl] cyclobutanecarboxylate Openeye Name: [1-methyl-3-oxido-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-yl] cyclobutanecarboxylate CAS Name: cyclobutanecarboxylic acid [1-methyl-3-oxido-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-4-imidazolidin-3-iumyl] ester IUPAC Name: [1-methyl-3-oxido-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-yl] cyclobutanecarboxylate Traditional Name: cyclobutanecarboxylic acid [1-methyl-3-oxido-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-3-ium-4-yl] ester Formula: C12H15F3N4O3S MolecularWeight: 352.33271

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC([N+](C1)(C2=NN=C(S2)C(F)(F)F)[O-])OC(=O)C3CCC3

Isomeric SMILES

CN1CC([N+](C1)(C2=NN=C(S2)C(F)(F)F)[O-])OC(=O)C3CCC3

InChI

InChI=1S/C12H15F3N4O3S/c1-18-5-8(22-9(20)7-3-2-4-7)19(21,6-18)11-17-16-10(23-11)12(13,14)15/h7-8H,2-6H2,1H3