7-[4-(hydroxymethyl)thiolan-3-yl]heptanoic acid

Systemtic Name: 7-[4-(hydroxymethyl)thiolan-3-yl]heptanoic acid Openeye Name: 7-[4-(hydroxymethyl)tetrahydrothiophen-3-yl]heptanoic acid CAS Name: 7-[4-(hydroxymethyl)-3-thiolanyl]heptanoic acid IUPAC Name: 7-[4-(hydroxymethyl)thiolan-3-yl]heptanoic acid Traditional Name: 7-(4-methyloltetrahydrothiophen-3-yl)enanthic acid Formula: C12H22O3S MolecularWeight: 246.36628

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CS1)CO)CCCCCCC(=O)O

Isomeric SMILES

C1C(C(CS1)CO)CCCCCCC(=O)O

InChI

InChI=1S/C12H22O3S/c13-7-11-9-16-8-10(11)5-3-1-2-4-6-12(14)15/h10-11,13H,1-9H2,(H,14,15)