(3,3-dimethyl-2-oxidanylidene-pentanoyl) 1-iodanylpyrrolidine-2-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-pentanoyl) 1-iodanylpyrrolidine-2-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-pentanoyl) 1-iodopyrrolidine-2-carboxylate CAS Name: 1-iodo-2-pyrrolidinecarboxylic acid (3,3-dimethyl-1,2-dioxopentyl) ester IUPAC Name: (3,3-dimethyl-2-oxopentanoyl) 1-iodopyrrolidine-2-carboxylate Traditional Name: 1-iodopyrrolidine-2-carboxylic acid (2-keto-3,3-dimethyl-pentanoyl) ester Formula: C12H18INO4 MolecularWeight: 367.18009

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)OC(=O)C1CCCN1I

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)OC(=O)C1CCCN1I

InChI

InChI=1S/C12H18INO4/c1-4-12(2,3)9(15)11(17)18-10(16)8-6-5-7-14(8)13/h8H,4-7H2,1-3H3