2-oxidanylidene-2-(2-pentylphenoxy)ethanoic acid

Systemtic Name: 2-oxidanylidene-2-(2-pentylphenoxy)ethanoic acid Openeye Name: 2-oxo-2-(2-pentylphenoxy)acetic acid CAS Name: 2-oxo-2-(2-pentylphenoxy)acetic acid IUPAC Name: 2-oxo-2-(2-pentylphenoxy)acetic acid Traditional Name: 2-(2-amylphenoxy)-2-keto-acetic acid Formula: C13H16O4 MolecularWeight: 236.26374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1OC(=O)C(=O)O

Isomeric SMILES

CCCCCC1=CC=CC=C1OC(=O)C(=O)O

InChI

InChI=1S/C13H16O4/c1-2-3-4-7-10-8-5-6-9-11(10)17-13(16)12(14)15/h5-6,8-9H,2-4,7H2,1H3,(H,14,15)