(4-iodophenyl) 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: (4-iodophenyl) 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: (4-iodophenyl) 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid (4-iodophenyl) ester Formula: C17H17IN2O4S MolecularWeight: 472.29735

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=C(C=C2)I)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=C(C=C2)I)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H17IN2O4S/c18-14-3-5-15(6-4-14)24-17(21)13-7-10-20(11-8-13)25(22,23)16-2-1-9-19-12-16/h1-6,9,12-13H,7-8,10-11H2