2-iodanyl-4-[(1R,2S)-1-oxidanyl-2-[4-(phenylmethyl)piperidin-1-yl]propyl]phenol

Systemtic Name: 2-iodanyl-4-[(1R,2S)-1-oxidanyl-2-[4-(phenylmethyl)piperidin-1-yl]propyl]phenol Openeye Name: 4-[(1R,2S)-2-(4-benzyl-1-piperidyl)-1-hydroxy-propyl]-2-iodanyl-phenol CAS Name: 4-[(1R,2S)-1-hydroxy-2-[4-(phenylmethyl)-1-piperidinyl]propyl]-2-iodanylphenol IUPAC Name: 4-[(1R,2S)-2-(4-benzylpiperidin-1-yl)-1-hydroxypropyl]-2-iodanylphenol Traditional Name: 4-[(1R,2S)-2-(4-benzylpiperidino)-1-hydroxy-propyl]-2-iodanyl-phenol Formula: C21H26INO2 MolecularWeight: 449.341264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC(=C(C=C1)O)I)O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@@H]([C@@H](C1=CC(=C(C=C1)O)[125I])O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26INO2/c1-15(21(25)18-7-8-20(24)19(22)14-18)23-11-9-17(10-12-23)13-16-5-3-2-4-6-16/h2-8,14-15,17,21,24-25H,9-13H2,1H3/t15-,21-/m0/s1/i22-2