1,4-didecoxy-2-ethynyl-5-iodanyl-benzene

Systemtic Name: 1,4-didecoxy-2-ethynyl-5-iodanyl-benzene Openeye Name: 1,4-didecoxy-2-ethynyl-5-iodo-benzene CAS Name: 1,4-didecoxy-2-ethynyl-5-iodobenzene IUPAC Name: 1,4-didecoxy-2-ethynyl-5-iodobenzene Traditional Name: 1,4-didecoxy-2-ethynyl-5-iodo-benzene Formula: C28H45IO2 MolecularWeight: 540.56017

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=C(C=C1C#C)OCCCCCCCCCC)I

Isomeric SMILES

CCCCCCCCCCOC1=CC(=C(C=C1C#C)OCCCCCCCCCC)I

InChI

InChI=1S/C28H45IO2/c1-4-7-9-11-13-15-17-19-21-30-27-24-26(29)28(23-25(27)6-3)31-22-20-18-16-14-12-10-8-5-2/h3,23-24H,4-5,7-22H2,1-2H3