[2-(3-oxidanylpentadecyl)phenyl]-phenyl-iodanium

Systemtic Name: [2-(3-oxidanylpentadecyl)phenyl]-phenyl-iodanium Openeye Name: [2-(3-hydroxypentadecyl)phenyl]-phenyl-iodonium CAS Name: [2-(3-hydroxypentadecyl)phenyl]-phenyliodonium IUPAC Name: [2-(3-hydroxypentadecyl)phenyl]-phenyliodanium Traditional Name: [2-(3-hydroxypentadecyl)phenyl]-phenyl-iodonium Formula: C27H40IO+ MolecularWeight: 507.51037

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC1=CC=CC=C1[I+]C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCCC(CCC1=CC=CC=C1[I+]C2=CC=CC=C2)O

InChI

InChI=1S/C27H40IO/c1-2-3-4-5-6-7-8-9-10-14-20-26(29)23-22-24-17-15-16-21-27(24)28-25-18-12-11-13-19-25/h11-13,15-19,21,26,29H,2-10,14,20,22-23H2,1H3/q+1