2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)ethanoate

Systemtic Name: 2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)ethanoate Openeye Name: 2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)acetate CAS Name: 2-(4-acetyl-3-hydroxy-2-propylphenoxy)acetate IUPAC Name: 2-(4-acetyl-3-hydroxy-2-propylphenoxy)acetate Traditional Name: 2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)acetate Formula: C13H15O5- MolecularWeight: 251.2552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(=O)[O-]

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(=O)[O-]

InChI

InChI=1S/C13H16O5/c1-3-4-10-11(18-7-12(15)16)6-5-9(8(2)14)13(10)17/h5-6,17H,3-4,7H2,1-2H3,(H,15,16)/p-1