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4-oxidanylidene-5-propan-2-yl-thiolane-3-carboxylic acid

4-oxidanylidene-5-propan-2-yl-thiolane-3-carboxylic acid

Systemtic Name:4-oxidanylidene-5-propan-2-yl-thiolane-3-carboxylic acid
Openeye Name:5-isopropyl-4-oxo-tetrahydrothiophene-3-carboxylic acid
CAS Name:4-oxo-5-propan-2-yl-3-thiolanecarboxylic acid
IUPAC Name:4-oxo-5-propan-2-ylthiolane-3-carboxylic acid
Traditional Name:5-isopropyl-4-keto-tetrahydrothiophene-3-carboxylic acid
Formula: C8H12O3S
MolecularWeight: 188.24408
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)C(CS1)C(=O)O


Isomeric SMILES

CC(C)C1C(=O)C(CS1)C(=O)O


InChI

InChI=1S/C8H12O3S/c1-4(2)7-6(9)5(3-12-7)8(10)11/h4-5,7H,3H2,1-2H3,(H,10,11)


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