tert-butyl 2-[1-(3-iodanylpropyl)-3-oxidanylidene-2-benzofuran-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[1-(3-iodanylpropyl)-3-oxidanylidene-2-benzofuran-1-yl]ethanoate Openeye Name: tert-butyl 2-[1-(3-iodopropyl)-3-oxo-isobenzofuran-1-yl]acetate CAS Name: 2-[1-(3-iodopropyl)-3-oxo-1-isobenzofuranyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-(3-iodopropyl)-3-oxo-2-benzofuran-1-yl]acetate Traditional Name: 2-[1-(3-iodopropyl)-3-keto-phthalan-1-yl]acetic acid tert-butyl ester Formula: C17H21IO4 MolecularWeight: 416.25071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1(C2=CC=CC=C2C(=O)O1)CCCI

Isomeric SMILES

CC(C)(C)OC(=O)CC1(C2=CC=CC=C2C(=O)O1)CCCI

InChI

InChI=1S/C17H21IO4/c1-16(2,3)21-14(19)11-17(9-6-10-18)13-8-5-4-7-12(13)15(20)22-17/h4-5,7-8H,6,9-11H2,1-3H3