(phenylmethyl) 4-iodanyl-3-oxidanyl-5-phenylmethoxy-benzoate

Systemtic Name: (phenylmethyl) 4-iodanyl-3-oxidanyl-5-phenylmethoxy-benzoate Openeye Name: benzyl 3-benzyloxy-5-hydroxy-4-iodo-benzoate CAS Name: 3-hydroxy-4-iodo-5-phenylmethoxybenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-hydroxy-4-iodo-5-phenylmethoxybenzoate Traditional Name: 3-benzoxy-5-hydroxy-4-iodo-benzoic acid benzyl ester Formula: C21H17IO4 MolecularWeight: 460.26175

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=CC(=C2I)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=CC(=C2I)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H17IO4/c22-20-18(23)11-17(21(24)26-14-16-9-5-2-6-10-16)12-19(20)25-13-15-7-3-1-4-8-15/h1-12,23H,13-14H2