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4-methyl-3-[2-(2,4,6-trimethylphenyl)sulfanylethyl]-1,2,3-oxadiazol-3-ium-5-olate
4-methyl-3-[2-(2,4,6-trimethylphenyl)sulfanylethyl]-1,2,3-oxadiazol-3-ium-5-olate
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=C(C(=C1)C)SCC[N+]2=NOC(=C2C)[O-])C
Isomeric SMILES
CC1=CC(=C(C(=C1)C)SCC[N+]2=NOC(=C2C)[O-])C
InChI
InChI=1S/C14H18N2O2S/c1-9-7-10(2)13(11(3)8-9)19-6-5-16-12(4)14(17)18-15-16/h7-8H,5-6H2,1-4H3
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