3,4,5-tributyl-6-iodanyl-benzene-1,2-diol

Systemtic Name: 3,4,5-tributyl-6-iodanyl-benzene-1,2-diol Openeye Name: 3,4,5-tributyl-6-iodo-benzene-1,2-diol CAS Name: 3,4,5-tributyl-6-iodobenzene-1,2-diol IUPAC Name: 3,4,5-tributyl-6-iodobenzene-1,2-diol Traditional Name: 3,4,5-tributyl-6-iodo-pyrocatechol Formula: C18H29IO2 MolecularWeight: 404.32613

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C(=C1CCCC)I)O)O)CCCC

Isomeric SMILES

CCCCC1=C(C(=C(C(=C1CCCC)I)O)O)CCCC

InChI

InChI=1S/C18H29IO2/c1-4-7-10-13-14(11-8-5-2)16(19)18(21)17(20)15(13)12-9-6-3/h20-21H,4-12H2,1-3H3