tert-butyl 3-(4-chloranyl-3-iodanyl-phenyl)carbonyl-4-oxidanylidene-piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-(4-chloranyl-3-iodanyl-phenyl)carbonyl-4-oxidanylidene-piperidine-1-carboxylate Openeye Name: tert-butyl 3-(4-chloro-3-iodo-benzoyl)-4-oxo-piperidine-1-carboxylate CAS Name: 3-[(4-chloro-3-iodophenyl)-oxomethyl]-4-oxo-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-chloro-3-iodobenzoyl)-4-oxopiperidine-1-carboxylate Traditional Name: 3-(4-chloro-3-iodo-benzoyl)-4-keto-piperidine-1-carboxylic acid tert-butyl ester Formula: C17H19ClINO4 MolecularWeight: 463.69453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(=O)C(C1)C(=O)C2=CC(=C(C=C2)Cl)I

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(=O)C(C1)C(=O)C2=CC(=C(C=C2)Cl)I

InChI

InChI=1S/C17H19ClINO4/c1-17(2,3)24-16(23)20-7-6-14(21)11(9-20)15(22)10-4-5-12(18)13(19)8-10/h4-5,8,11H,6-7,9H2,1-3H3