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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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