(2,5-dimethylphenyl) 3-iodanyl-4-methyl-benzoate

Systemtic Name: (2,5-dimethylphenyl) 3-iodanyl-4-methyl-benzoate Openeye Name: (2,5-dimethylphenyl) 3-iodo-4-methyl-benzoate CAS Name: 3-iodo-4-methylbenzoic acid (2,5-dimethylphenyl) ester IUPAC Name: (2,5-dimethylphenyl) 3-iodo-4-methylbenzoate Traditional Name: 3-iodo-4-methyl-benzoic acid (2,5-dimethylphenyl) ester Formula: C16H15IO2 MolecularWeight: 366.19357

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC(=O)C2=CC(=C(C=C2)C)I

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC(=O)C2=CC(=C(C=C2)C)I

InChI

InChI=1S/C16H15IO2/c1-10-4-5-12(3)15(8-10)19-16(18)13-7-6-11(2)14(17)9-13/h4-9H,1-3H3