1-(diethoxyphosphorylmethyl)-3-[(E)-2-(4-hexoxyphenyl)ethenyl]-5-iodanyl-benzene

Systemtic Name: 1-(diethoxyphosphorylmethyl)-3-[(E)-2-(4-hexoxyphenyl)ethenyl]-5-iodanyl-benzene Openeye Name: 1-(diethoxyphosphorylmethyl)-3-[(E)-2-(4-hexoxyphenyl)vinyl]-5-iodo-benzene CAS Name: 1-(diethoxyphosphorylmethyl)-3-[(E)-2-(4-hexoxyphenyl)ethenyl]-5-iodobenzene IUPAC Name: 1-(diethoxyphosphorylmethyl)-3-[(E)-2-(4-hexoxyphenyl)ethenyl]-5-iodobenzene Traditional Name: 1-(diethoxyphosphorylmethyl)-3-[(E)-2-(4-hexoxyphenyl)vinyl]-5-iodo-benzene Formula: C25H34IO4P MolecularWeight: 556.413291

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=CC2=CC(=CC(=C2)I)CP(=O)(OCC)OCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=C/C2=CC(=CC(=C2)I)CP(=O)(OCC)OCC

InChI

InChI=1S/C25H34IO4P/c1-4-7-8-9-16-28-25-14-12-21(13-15-25)10-11-22-17-23(19-24(26)18-22)20-31(27,29-5-2)30-6-3/h10-15,17-19H,4-9,16,20H2,1-3H3/b11-10+