(2-ethanoylphenyl) 3-iodanyl-4-methyl-benzoate

Systemtic Name: (2-ethanoylphenyl) 3-iodanyl-4-methyl-benzoate Openeye Name: (2-acetylphenyl) 3-iodo-4-methyl-benzoate CAS Name: 3-iodo-4-methylbenzoic acid (2-acetylphenyl) ester IUPAC Name: (2-acetylphenyl) 3-iodo-4-methylbenzoate Traditional Name: 3-iodo-4-methyl-benzoic acid (2-acetylphenyl) ester Formula: C16H13IO3 MolecularWeight: 380.17709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)C)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)C)I

InChI

InChI=1S/C16H13IO3/c1-10-7-8-12(9-14(10)17)16(19)20-15-6-4-3-5-13(15)11(2)18/h3-9H,1-2H3