3-iodanyl-4,5,6-tri(nonyl)benzene-1,2-diol

Systemtic Name: 3-iodanyl-4,5,6-tri(nonyl)benzene-1,2-diol Openeye Name: 3-iodo-4,5,6-tri(nonyl)benzene-1,2-diol CAS Name: 3-iodo-4,5,6-tri(nonyl)benzene-1,2-diol IUPAC Name: 3-iodo-4,5,6-tri(nonyl)benzene-1,2-diol Traditional Name: 3-iodo-4,5,6-tri(nonyl)pyrocatechol Formula: C33H59IO2 MolecularWeight: 614.72483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=C(C(=C1CCCCCCCCC)I)O)O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC1=C(C(=C(C(=C1CCCCCCCCC)I)O)O)CCCCCCCCC

InChI

InChI=1S/C33H59IO2/c1-4-7-10-13-16-19-22-25-28-29(26-23-20-17-14-11-8-5-2)31(34)33(36)32(35)30(28)27-24-21-18-15-12-9-6-3/h35-36H,4-27H2,1-3H3