3-[1,1-bis(iodanyl)heptyl]benzene-1,2-diol

Systemtic Name: 3-[1,1-bis(iodanyl)heptyl]benzene-1,2-diol Openeye Name: 3-(1,1-diiodoheptyl)benzene-1,2-diol CAS Name: 3-(1,1-diiodoheptyl)benzene-1,2-diol IUPAC Name: 3-(1,1-diiodoheptyl)benzene-1,2-diol Traditional Name: 3-(1,1-diiodoheptyl)pyrocatechol Formula: C13H18I2O2 MolecularWeight: 460.08976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18I2O2/c1-2-3-4-5-9-13(14,15)10-7-6-8-11(16)12(10)17/h6-8,16-17H,2-5,9H2,1H3