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

Systemtic Name: [3-methyl-1-oxidanidyl-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-1-ium-2-yl] ethanoate Openeye Name: [3-methyl-1-oxido-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-1-ium-2-yl] acetate CAS Name: acetic 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] acetate Traditional Name: acetic acid [3-methyl-1-oxido-1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]imidazolidin-1-ium-2-yl] ester Formula: C9H11F3N4O3S MolecularWeight: 312.26885

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11F3N4O3S/c1-5(17)19-8-15(2)3-4-16(8,18)7-14-13-6(20-7)9(10,11)12/h8H,3-4H2,1-2H3