(phenylmethyl) 6-iodanyl-5,6-bis(oxidanylidene)hexanoate

Systemtic Name: (phenylmethyl) 6-iodanyl-5,6-bis(oxidanylidene)hexanoate Openeye Name: benzyl 6-iodo-5,6-dioxo-hexanoate CAS Name: 6-iodo-5,6-dioxohexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-iodo-5,6-dioxohexanoate Traditional Name: 6-iodo-5,6-diketo-hexanoic acid benzyl ester Formula: C13H13IO4 MolecularWeight: 360.14439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCC(=O)C(=O)I

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCC(=O)C(=O)I

InChI

InChI=1S/C13H13IO4/c14-13(17)11(15)7-4-8-12(16)18-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2