methyl 1-(4-iodophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(4-iodophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: methyl 1-(4-iodophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-iodophenyl)sulfonyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-iodophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-iodophenyl)sulfonylisonipecotic acid methyl ester Formula: C13H16INO4S MolecularWeight: 409.23991

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16INO4S/c1-19-13(16)10-6-8-15(9-7-10)20(17,18)12-4-2-11(14)3-5-12/h2-5,10H,6-9H2,1H3