2-(6-heptyl-6-methyl-2-oxidanylidene-1,4-oxathian-3-yl)ethanoic acid

Systemtic Name: 2-(6-heptyl-6-methyl-2-oxidanylidene-1,4-oxathian-3-yl)ethanoic acid Openeye Name: 2-(6-heptyl-6-methyl-2-oxo-1,4-oxathian-3-yl)acetic acid CAS Name: 2-(6-heptyl-6-methyl-2-oxo-1,4-oxathian-3-yl)acetic acid IUPAC Name: 2-(6-heptyl-6-methyl-2-oxo-1,4-oxathian-3-yl)acetic acid Traditional Name: 2-(6-heptyl-2-keto-6-methyl-1,4-oxathian-3-yl)acetic acid Formula: C14H24O4S MolecularWeight: 288.40296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CSC(C(=O)O1)CC(=O)O)C

Isomeric SMILES

CCCCCCCC1(CSC(C(=O)O1)CC(=O)O)C

InChI

InChI=1S/C14H24O4S/c1-3-4-5-6-7-8-14(2)10-19-11(9-12(15)16)13(17)18-14/h11H,3-10H2,1-2H3,(H,15,16)