tert-butyl 4-(6-ethoxy-5-iodanyl-6-oxidanylidene-hexan-2-yl)benzoate

Systemtic Name: tert-butyl 4-(6-ethoxy-5-iodanyl-6-oxidanylidene-hexan-2-yl)benzoate Openeye Name: tert-butyl 4-(5-ethoxy-4-iodo-1-methyl-5-oxo-pentyl)benzoate CAS Name: 4-(6-ethoxy-5-iodo-6-oxohexan-2-yl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-ethoxy-5-iodo-6-oxohexan-2-yl)benzoate Traditional Name: 4-(5-ethoxy-4-iodo-5-keto-1-methyl-pentyl)benzoic acid tert-butyl ester Formula: C19H27IO4 MolecularWeight: 446.31975

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(C)C1=CC=C(C=C1)C(=O)OC(C)(C)C)I

Isomeric SMILES

CCOC(=O)C(CCC(C)C1=CC=C(C=C1)C(=O)OC(C)(C)C)I

InChI

InChI=1S/C19H27IO4/c1-6-23-18(22)16(20)12-7-13(2)14-8-10-15(11-9-14)17(21)24-19(3,4)5/h8-11,13,16H,6-7,12H2,1-5H3