2-(7-oxidanylideneheptan-3-yloxy)ethanoic acid

Systemtic Name: 2-(7-oxidanylideneheptan-3-yloxy)ethanoic acid Openeye Name: 2-(1-ethyl-5-oxo-pentoxy)acetic acid CAS Name: 2-(7-oxoheptan-3-yloxy)acetic acid IUPAC Name: 2-(7-oxoheptan-3-yloxy)acetic acid Traditional Name: 2-(1-ethyl-5-keto-pentoxy)acetic acid Formula: C9H16O4 MolecularWeight: 188.22094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCC=O)OCC(=O)O

Isomeric SMILES

CCC(CCCC=O)OCC(=O)O

InChI

InChI=1S/C9H16O4/c1-2-8(5-3-4-6-10)13-7-9(11)12/h6,8H,2-5,7H2,1H3,(H,11,12)