tert-butyl (2R,5S)-2-butyl-5-(5-ethoxy-4-iodanyl-5-oxidanylidene-pentyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,5S)-2-butyl-5-(5-ethoxy-4-iodanyl-5-oxidanylidene-pentyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R,5S)-2-butyl-5-(5-ethoxy-4-iodo-5-oxo-pentyl)pyrrolidine-1-carboxylate CAS Name: (2R,5S)-2-butyl-5-(5-ethoxy-4-iodo-5-oxopentyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,5S)-2-butyl-5-(5-ethoxy-4-iodo-5-oxopentyl)pyrrolidine-1-carboxylate Traditional Name: (2R,5S)-2-butyl-5-(5-ethoxy-4-iodo-5-keto-pentyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H36INO4 MolecularWeight: 481.40861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(N1C(=O)OC(C)(C)C)CCCC(C(=O)OCC)I

Isomeric SMILES

CCCC[C@@H]1CC[C@@H](N1C(=O)OC(C)(C)C)CCCC(C(=O)OCC)I

InChI

InChI=1S/C20H36INO4/c1-6-8-10-15-13-14-16(22(15)19(24)26-20(3,4)5)11-9-12-17(21)18(23)25-7-2/h15-17H,6-14H2,1-5H3/t15-,16+,17?/m1/s1