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2-(1-cyclooctylimidazol-2-yl)sulfanylethanoate

2-(1-cyclooctylimidazol-2-yl)sulfanylethanoate

Systemtic Name:2-(1-cyclooctylimidazol-2-yl)sulfanylethanoate
Openeye Name:2-(1-cyclooctylimidazol-2-yl)sulfanylacetate
CAS Name:2-[(1-cyclooctyl-2-imidazolyl)thio]acetate
IUPAC Name:2-(1-cyclooctylimidazol-2-yl)sulfanylacetate
Traditional Name:2-[(1-cyclooctylimidazol-2-yl)thio]acetate
Formula: C13H19N2O2S-
MolecularWeight: 267.36716
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)N2C=CN=C2SCC(=O)[O-]


Isomeric SMILES

C1CCCC(CCC1)N2C=CN=C2SCC(=O)[O-]


InChI

InChI=1S/C13H20N2O2S/c16-12(17)10-18-13-14-8-9-15(13)11-6-4-2-1-3-5-7-11/h8-9,11H,1-7,10H2,(H,16,17)/p-1


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