hexyl 4-iodanylbenzoate

Systemtic Name: hexyl 4-iodanylbenzoate Openeye Name: hexyl 4-iodobenzoate CAS Name: 4-iodobenzoic acid hexyl ester IUPAC Name: hexyl 4-iodobenzoate Traditional Name: 4-iodobenzoic acid hexyl ester Formula: C13H17IO2 MolecularWeight: 332.17735

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17IO2/c1-2-3-4-5-10-16-13(15)11-6-8-12(14)9-7-11/h6-9H,2-5,10H2,1H3