phenyl (2S,4R)-5-iodanyl-4-oxidanyl-2-(3-phenylmethoxypropyl)-3,4-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: phenyl (2S,4R)-5-iodanyl-4-oxidanyl-2-(3-phenylmethoxypropyl)-3,4-dihydro-2H-pyridine-1-carboxylate Openeye Name: phenyl (2S,4R)-2-(3-benzyloxypropyl)-4-hydroxy-5-iodo-3,4-dihydro-2H-pyridine-1-carboxylate CAS Name: (2S,4R)-4-hydroxy-5-iodo-2-(3-phenylmethoxypropyl)-3,4-dihydro-2H-pyridine-1-carboxylic acid phenyl ester IUPAC Name: phenyl (2S,4R)-4-hydroxy-5-iodo-2-(3-phenylmethoxypropyl)-3,4-dihydro-2H-pyridine-1-carboxylate Traditional Name: (2S,4R)-2-(3-benzoxypropyl)-4-hydroxy-5-iodo-3,4-dihydro-2H-pyridine-1-carboxylic acid phenyl ester Formula: C22H24INO4 MolecularWeight: 493.33473

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C=C(C1O)I)C(=O)OC2=CC=CC=C2)CCCOCC3=CC=CC=C3

Isomeric SMILES

C1[C@@H](N(C=C([C@@H]1O)I)C(=O)OC2=CC=CC=C2)CCCOCC3=CC=CC=C3

InChI

InChI=1S/C22H24INO4/c23-20-15-24(22(26)28-19-11-5-2-6-12-19)18(14-21(20)25)10-7-13-27-16-17-8-3-1-4-9-17/h1-6,8-9,11-12,15,18,21,25H,7,10,13-14,16H2/t18-,21+/m0/s1