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heptyl 3-oxidanylthiolane-2-carboxylate

heptyl 3-oxidanylthiolane-2-carboxylate

Systemtic Name:heptyl 3-oxidanylthiolane-2-carboxylate
Openeye Name:heptyl 3-hydroxytetrahydrothiophene-2-carboxylate
CAS Name:3-hydroxy-2-thiolanecarboxylic acid heptyl ester
IUPAC Name:heptyl 3-hydroxythiolane-2-carboxylate
Traditional Name:3-hydroxytetrahydrothiophene-2-carboxylic acid heptyl ester
Formula: C12H22O3S
MolecularWeight: 246.36628
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1C(CCS1)O


Isomeric SMILES

CCCCCCCOC(=O)C1C(CCS1)O


InChI

InChI=1S/C12H22O3S/c1-2-3-4-5-6-8-15-12(14)11-10(13)7-9-16-11/h10-11,13H,2-9H2,1H3


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