4-oxidanyl-3-pentyl-benzoate

Systemtic Name: 4-oxidanyl-3-pentyl-benzoate Openeye Name: 4-hydroxy-3-pentyl-benzoate CAS Name: 4-hydroxy-3-pentylbenzoate IUPAC Name: 4-hydroxy-3-pentylbenzoate Traditional Name: 3-amyl-4-hydroxy-benzoate Formula: C12H15O3- MolecularWeight: 207.2457

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1)C(=O)[O-])O

Isomeric SMILES

CCCCCC1=C(C=CC(=C1)C(=O)[O-])O

InChI

InChI=1S/C12H16O3/c1-2-3-4-5-9-8-10(12(14)15)6-7-11(9)13/h6-8,13H,2-5H2,1H3,(H,14,15)/p-1