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[2,4,6-tris(chloranyl)phenyl] 4-ethyl-3-oxidanylidene-octane-1-sulfonate

[2,4,6-tris(chloranyl)phenyl] 4-ethyl-3-oxidanylidene-octane-1-sulfonate

Systemtic Name:[2,4,6-tris(chloranyl)phenyl] 4-ethyl-3-oxidanylidene-octane-1-sulfonate
Openeye Name:(2,4,6-trichlorophenyl) 4-ethyl-3-oxo-octane-1-sulfonate
CAS Name:4-ethyl-3-oxo-1-octanesulfonic acid
IUPAC Name:(2,4,6-trichlorophenyl) 4-ethyl-3-oxooctane-1-sulfonate
Traditional Name:4-ethyl-3-keto-octane-1-sulfonic acid (2,4,6-trichlorophenyl) ester
Formula: C16H21Cl3O4S
MolecularWeight: 415.75954
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)CCS(=O)(=O)OC1=C(C=C(C=C1Cl)Cl)Cl


Isomeric SMILES

CCCCC(CC)C(=O)CCS(=O)(=O)OC1=C(C=C(C=C1Cl)Cl)Cl


InChI

InChI=1S/C16H21Cl3O4S/c1-3-5-6-11(4-2)15(20)7-8-24(21,22)23-16-13(18)9-12(17)10-14(16)19/h9-11H,3-8H2,1-2H3


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