2-(4-iodophenyl)-3-methyl-pentadecanoic acid

Systemtic Name: 2-(4-iodophenyl)-3-methyl-pentadecanoic acid Openeye Name: 2-(4-iodophenyl)-3-methyl-pentadecanoic acid CAS Name: 2-(4-iodophenyl)-3-methylpentadecanoic acid IUPAC Name: 2-(4-iodophenyl)-3-methylpentadecanoic acid Traditional Name: 2-(4-iodophenyl)-3-methyl-pentadecanoic acid Formula: C22H35IO2 MolecularWeight: 458.41657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)C(C1=CC=C(C=C1)I)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC(C)C(C1=CC=C(C=C1)I)C(=O)O

InChI

InChI=1S/C22H35IO2/c1-3-4-5-6-7-8-9-10-11-12-13-18(2)21(22(24)25)19-14-16-20(23)17-15-19/h14-18,21H,3-13H2,1-2H3,(H,24,25)