(4-chloranyl-3,5-dimethyl-phenyl) 3-iodanyl-4-methyl-benzoate

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) 3-iodanyl-4-methyl-benzoate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) 3-iodo-4-methyl-benzoate CAS Name: 3-iodo-4-methylbenzoic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) 3-iodo-4-methylbenzoate Traditional Name: 3-iodo-4-methyl-benzoic acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C16H14ClIO2 MolecularWeight: 400.63863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC(=C(C(=C2)C)Cl)C)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC(=C(C(=C2)C)Cl)C)I

InChI

InChI=1S/C16H14ClIO2/c1-9-4-5-12(8-14(9)18)16(19)20-13-6-10(2)15(17)11(3)7-13/h4-8H,1-3H3