2-iodanylbutyl 1-[2,5-bis(oxidanylidene)pyrrol-3-yl]cyclopentane-1-carboxylate

Systemtic Name: 2-iodanylbutyl 1-[2,5-bis(oxidanylidene)pyrrol-3-yl]cyclopentane-1-carboxylate Openeye Name: 2-iodobutyl 1-(2,5-dioxopyrrol-3-yl)cyclopentanecarboxylate CAS Name: 1-(2,5-dioxo-3-pyrrolyl)-1-cyclopentanecarboxylic acid 2-iodobutyl ester IUPAC Name: 2-iodobutyl 1-(2,5-dioxopyrrol-3-yl)cyclopentane-1-carboxylate Traditional Name: 1-(2,5-diketo-3-pyrrolin-3-yl)cyclopentanecarboxylic acid 2-iodobutyl ester Formula: C14H18INO4 MolecularWeight: 391.20149

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)C1(CCCC1)C2=CC(=O)NC2=O)I

Isomeric SMILES

CCC(COC(=O)C1(CCCC1)C2=CC(=O)NC2=O)I

InChI

InChI=1S/C14H18INO4/c1-2-9(15)8-20-13(19)14(5-3-4-6-14)10-7-11(17)16-12(10)18/h7,9H,2-6,8H2,1H3,(H,16,17,18)