ethyl 1-(3-iodanyl-4-methyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-iodanyl-4-methyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(3-iodo-4-methyl-benzoyl)piperidine-4-carboxylate CAS Name: 1-[(3-iodo-4-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-iodo-4-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-(3-iodo-4-methyl-benzoyl)isonipecotic acid ethyl ester Formula: C16H20INO3 MolecularWeight: 401.23937

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)I

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)I

InChI

InChI=1S/C16H20INO3/c1-3-21-16(20)12-6-8-18(9-7-12)15(19)13-5-4-11(2)14(17)10-13/h4-5,10,12H,3,6-9H2,1-2H3