methyl 1-(4-iodophenyl)sulfonylpiperidine-2-carboxylate

Systemtic Name: methyl 1-(4-iodophenyl)sulfonylpiperidine-2-carboxylate Openeye Name: methyl 1-(4-iodophenyl)sulfonylpiperidine-2-carboxylate CAS Name: 1-(4-iodophenyl)sulfonyl-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-iodophenyl)sulfonylpiperidine-2-carboxylate Traditional Name: 1-(4-iodophenyl)sulfonylpipecolinic acid methyl ester Formula: C13H16INO4S MolecularWeight: 409.23991

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCCN1S(=O)(=O)C2=CC=C(C=C2)I

Isomeric SMILES

COC(=O)C1CCCCN1S(=O)(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C13H16INO4S/c1-19-13(16)12-4-2-3-9-15(12)20(17,18)11-7-5-10(14)6-8-11/h5-8,12H,2-4,9H2,1H3