3-heptanoyloxythiolane-2-carboxylic acid

Systemtic Name: 3-heptanoyloxythiolane-2-carboxylic acid Openeye Name: 3-heptanoyloxytetrahydrothiophene-2-carboxylic acid CAS Name: 3-(1-oxoheptoxy)-2-thiolanecarboxylic acid IUPAC Name: 3-heptanoyloxythiolane-2-carboxylic acid Traditional Name: 3-enanthyloxytetrahydrothiophene-2-carboxylic acid Formula: C12H20O4S MolecularWeight: 260.3498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1CCSC1C(=O)O

Isomeric SMILES

CCCCCCC(=O)OC1CCSC1C(=O)O

InChI

InChI=1S/C12H20O4S/c1-2-3-4-5-6-10(13)16-9-7-8-17-11(9)12(14)15/h9,11H,2-8H2,1H3,(H,14,15)