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2-(2-hexyl-2-methyl-5-oxidanylidene-thiophen-3-yl)oxyethanoic acid

2-(2-hexyl-2-methyl-5-oxidanylidene-thiophen-3-yl)oxyethanoic acid

Systemtic Name:2-(2-hexyl-2-methyl-5-oxidanylidene-thiophen-3-yl)oxyethanoic acid
Openeye Name:2-[(2-hexyl-2-methyl-5-oxo-3-thienyl)oxy]acetic acid
CAS Name:2-[(2-hexyl-2-methyl-5-oxo-3-thiophenyl)oxy]acetic acid
IUPAC Name:2-(2-hexyl-2-methyl-5-oxothiophen-3-yl)oxyacetic acid
Traditional Name:2-[(2-hexyl-5-keto-2-methyl-3-thienyl)oxy]acetic acid
Formula: C13H20O4S
MolecularWeight: 272.3605
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C(=CC(=O)S1)OCC(=O)O)C


Isomeric SMILES

CCCCCCC1(C(=CC(=O)S1)OCC(=O)O)C


InChI

InChI=1S/C13H20O4S/c1-3-4-5-6-7-13(2)10(8-12(16)18-13)17-9-11(14)15/h8H,3-7,9H2,1-2H3,(H,14,15)


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