2-(3-pentyl-1,2-oxathian-3-yl)ethanoic acid

Systemtic Name: 2-(3-pentyl-1,2-oxathian-3-yl)ethanoic acid Openeye Name: 2-(3-pentyloxathian-3-yl)acetic acid CAS Name: 2-(3-pentyl-3-oxathianyl)acetic acid IUPAC Name: 2-(3-pentyloxathian-3-yl)acetic acid Traditional Name: 2-(3-amyloxathian-3-yl)acetic acid Formula: C11H20O3S MolecularWeight: 232.3397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(CCCOS1)CC(=O)O

Isomeric SMILES

CCCCCC1(CCCOS1)CC(=O)O

InChI

InChI=1S/C11H20O3S/c1-2-3-4-6-11(9-10(12)13)7-5-8-14-15-11/h2-9H2,1H3,(H,12,13)