methyl 2-iodanyl-6-(4-methylphenyl)carbonyl-benzoate

Systemtic Name: methyl 2-iodanyl-6-(4-methylphenyl)carbonyl-benzoate Openeye Name: methyl 2-iodo-6-(4-methylbenzoyl)benzoate CAS Name: 2-iodo-6-[(4-methylphenyl)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-iodo-6-(4-methylbenzoyl)benzoate Traditional Name: 2-iodo-6-p-toluoyl-benzoic acid methyl ester Formula: C16H13IO3 MolecularWeight: 380.17709

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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