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

Systemtic Name: 2-[(3E)-6-bromanyl-2-(phenylmethyl)-3-(phenylmethylidene)-1H-isoindol-5-yl]phenol Openeye Name: 2-[(3E)-2-benzyl-3-benzylidene-6-bromo-isoindolin-5-yl]phenol CAS Name: 2-[(3E)-6-bromo-2-(phenylmethyl)-3-(phenylmethylene)-1H-isoindol-5-yl]phenol IUPAC Name: 2-[(3E)-2-benzyl-3-benzylidene-6-bromo-1H-isoindol-5-yl]phenol Traditional Name: 2-[(3E)-3-benzal-2-benzyl-6-bromo-isoindolin-5-yl]phenol Formula: C28H22BrNO MolecularWeight: 468.38438

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C(=C2)Br)C3=CC=CC=C3O)C(=CC4=CC=CC=C4)N1CC5=CC=CC=C5

Isomeric SMILES

C1C2=C(C=C(C(=C2)Br)C3=CC=CC=C3O)/C(=C\C4=CC=CC=C4)/N1CC5=CC=CC=C5

InChI

InChI=1S/C28H22BrNO/c29-26-16-22-19-30(18-21-11-5-2-6-12-21)27(15-20-9-3-1-4-10-20)24(22)17-25(26)23-13-7-8-14-28(23)31/h1-17,31H,18-19H2/b27-15+