[9-(2-iodanylphenyl)-7-oxidanyl-9-oxidanylidene-non-1-en-3-yl] ethanoate

Systemtic Name: [9-(2-iodanylphenyl)-7-oxidanyl-9-oxidanylidene-non-1-en-3-yl] ethanoate Openeye Name: [5-hydroxy-7-(2-iodophenyl)-7-oxo-1-vinyl-heptyl] acetate CAS Name: acetic acid [7-hydroxy-9-(2-iodophenyl)-9-oxonon-1-en-3-yl] ester IUPAC Name: [7-hydroxy-9-(2-iodophenyl)-9-oxonon-1-en-3-yl] acetate Traditional Name: acetic acid 1-[4-hydroxy-6-(2-iodophenyl)-6-keto-hexyl]allyl ester Formula: C17H21IO4 MolecularWeight: 416.25071

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCCC(CC(=O)C1=CC=CC=C1I)O)C=C

Isomeric SMILES

CC(=O)OC(CCCC(CC(=O)C1=CC=CC=C1I)O)C=C

InChI

InChI=1S/C17H21IO4/c1-3-14(22-12(2)19)8-6-7-13(20)11-17(21)15-9-4-5-10-16(15)18/h3-5,9-10,13-14,20H,1,6-8,11H2,2H3