4-(2-iodanylphenyl)-9-methyl-pentadecanoic acid

Systemtic Name: 4-(2-iodanylphenyl)-9-methyl-pentadecanoic acid Openeye Name: 4-(2-iodophenyl)-9-methyl-pentadecanoic acid CAS Name: 4-(2-iodophenyl)-9-methylpentadecanoic acid IUPAC Name: 4-(2-iodophenyl)-9-methylpentadecanoic acid Traditional Name: 4-(2-iodophenyl)-9-methyl-pentadecanoic acid Formula: C22H35IO2 MolecularWeight: 458.41657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)CCCCC(CCC(=O)O)C1=CC=CC=C1I

Isomeric SMILES

CCCCCCC(C)CCCCC(CCC(=O)O)C1=CC=CC=C1I

InChI

InChI=1S/C22H35IO2/c1-3-4-5-6-11-18(2)12-7-8-13-19(16-17-22(24)25)20-14-9-10-15-21(20)23/h9-10,14-15,18-19H,3-8,11-13,16-17H2,1-2H3,(H,24,25)