4-iodanyl-2-pentyl-benzoic acid

Systemtic Name: 4-iodanyl-2-pentyl-benzoic acid Openeye Name: 4-iodo-2-pentyl-benzoic acid CAS Name: 4-iodo-2-pentylbenzoic acid IUPAC Name: 4-iodo-2-pentylbenzoic acid Traditional Name: 2-amyl-4-iodo-benzoic acid Formula: C12H15IO2 MolecularWeight: 318.15077

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC(=C1)I)C(=O)O

Isomeric SMILES

CCCCCC1=C(C=CC(=C1)I)C(=O)O

InChI

InChI=1S/C12H15IO2/c1-2-3-4-5-9-8-10(13)6-7-11(9)12(14)15/h6-8H,2-5H2,1H3,(H,14,15)