methyl 1-(5-bromanyl-2-iodanyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(5-bromanyl-2-iodanyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-(5-bromo-2-iodo-benzoyl)piperidine-4-carboxylate CAS Name: 1-[(5-bromo-2-iodophenyl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-bromo-2-iodobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(5-bromo-2-iodo-benzoyl)isonipecotic acid methyl ester Formula: C14H15BrINO3 MolecularWeight: 452.08227

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)Br)I

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)Br)I

InChI

InChI=1S/C14H15BrINO3/c1-20-14(19)9-4-6-17(7-5-9)13(18)11-8-10(15)2-3-12(11)16/h2-3,8-9H,4-7H2,1H3