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

Systemtic Name: 2-[(3E)-2-(2-hydroxyphenyl)-6-iodanyl-3-(phenylmethylidene)-1H-isoindol-5-yl]phenol Openeye Name: 2-[(3E)-3-benzylidene-2-(2-hydroxyphenyl)-6-iodo-isoindolin-5-yl]phenol CAS Name: 2-[(3E)-2-(2-hydroxyphenyl)-6-iodo-3-(phenylmethylene)-1H-isoindol-5-yl]phenol IUPAC Name: 2-[(3E)-3-benzylidene-2-(2-hydroxyphenyl)-6-iodo-1H-isoindol-5-yl]phenol Traditional Name: 2-[(3E)-3-benzal-2-(2-hydroxyphenyl)-6-iodo-isoindolin-5-yl]phenol Formula: C27H20INO2 MolecularWeight: 517.35767

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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)N1C5=CC=CC=C5O

Isomeric SMILES

C1C2=C(C=C(C(=C2)I)C3=CC=CC=C3O)/C(=C\C4=CC=CC=C4)/N1C5=CC=CC=C5O

InChI

InChI=1S/C27H20INO2/c28-23-15-19-17-29(24-11-5-7-13-27(24)31)25(14-18-8-2-1-3-9-18)21(19)16-22(23)20-10-4-6-12-26(20)30/h1-16,30-31H,17H2/b25-14+