tert-butyl 3-[bis(fluoranyl)-iodanyl-methyl]-2-oxidanylidene-3-(phenylmethyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[bis(fluoranyl)-iodanyl-methyl]-2-oxidanylidene-3-(phenylmethyl)piperidine-1-carboxylate Openeye Name: tert-butyl 3-benzyl-3-[difluoro(iodo)methyl]-2-oxo-piperidine-1-carboxylate CAS Name: 3-[difluoro(iodo)methyl]-2-oxo-3-(phenylmethyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-benzyl-3-[difluoro(iodo)methyl]-2-oxopiperidine-1-carboxylate Traditional Name: 3-benzyl-3-[difluoro(iodo)methyl]-2-keto-piperidine-1-carboxylic acid tert-butyl ester Formula: C18H22F2INO3 MolecularWeight: 465.273456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1=O)(CC2=CC=CC=C2)C(F)(F)I

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1=O)(CC2=CC=CC=C2)C(F)(F)I

InChI

InChI=1S/C18H22F2INO3/c1-16(2,3)25-15(24)22-11-7-10-17(14(22)23,18(19,20)21)12-13-8-5-4-6-9-13/h4-6,8-9H,7,10-12H2,1-3H3