heptyl 3,5-bis(iodanyl)-4-oxidanyl-benzoate

Systemtic Name: heptyl 3,5-bis(iodanyl)-4-oxidanyl-benzoate Openeye Name: heptyl 4-hydroxy-3,5-diiodo-benzoate CAS Name: 4-hydroxy-3,5-diiodobenzoic acid heptyl ester IUPAC Name: heptyl 4-hydroxy-3,5-diiodobenzoate Traditional Name: 4-hydroxy-3,5-diiodo-benzoic acid heptyl ester Formula: C14H18I2O3 MolecularWeight: 488.09986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18I2O3/c1-2-3-4-5-6-7-19-14(18)10-8-11(15)13(17)12(16)9-10/h8-9,17H,2-7H2,1H3