(phenylmethyl) 5-iodanyl-4-methyl-2-oxidanyl-benzoate

Systemtic Name: (phenylmethyl) 5-iodanyl-4-methyl-2-oxidanyl-benzoate Openeye Name: benzyl 2-hydroxy-5-iodo-4-methyl-benzoate CAS Name: 2-hydroxy-5-iodo-4-methylbenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-hydroxy-5-iodo-4-methylbenzoate Traditional Name: 2-hydroxy-5-iodo-4-methyl-benzoic acid benzyl ester Formula: C15H13IO3 MolecularWeight: 368.16639

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(=O)OCC2=CC=CC=C2)I

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(=O)OCC2=CC=CC=C2)I

InChI

InChI=1S/C15H13IO3/c1-10-7-14(17)12(8-13(10)16)15(18)19-9-11-5-3-2-4-6-11/h2-8,17H,9H2,1H3