2-[(3E)-6-iodanyl-2-oxidanyl-3-(phenylmethylidene)-1H-isoindol-5-yl]phenol

Systemtic Name: 2-[(3E)-6-iodanyl-2-oxidanyl-3-(phenylmethylidene)-1H-isoindol-5-yl]phenol Openeye Name: 2-[(3E)-3-benzylidene-2-hydroxy-6-iodo-isoindolin-5-yl]phenol CAS Name: 2-[(3E)-2-hydroxy-6-iodo-3-(phenylmethylene)-1H-isoindol-5-yl]phenol IUPAC Name: 2-[(3E)-3-benzylidene-2-hydroxy-6-iodo-1H-isoindol-5-yl]phenol Traditional Name: 2-[(3E)-3-benzal-2-hydroxy-6-iodo-isoindolin-5-yl]phenol Formula: C21H16INO2 MolecularWeight: 441.26171

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C(=C2)I)C3=CC=CC=C3O)C(=CC4=CC=CC=C4)N1O

Isomeric SMILES

C1C2=C(C=C(C(=C2)I)C3=CC=CC=C3O)/C(=C\C4=CC=CC=C4)/N1O

InChI

InChI=1S/C21H16INO2/c22-19-11-15-13-23(25)20(10-14-6-2-1-3-7-14)17(15)12-18(19)16-8-4-5-9-21(16)24/h1-12,24-25H,13H2/b20-10+