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

Systemtic Name: 2-[(1E)-6-(phenylmethyl)-1-(phenylmethylidene)-2-(phenylsulfonyl)-3H-isoindol-5-yl]phenol Openeye Name: 2-[(1E)-2-(benzenesulfonyl)-6-benzyl-1-benzylidene-isoindolin-5-yl]phenol CAS Name: 2-[(1E)-2-(benzenesulfonyl)-6-(phenylmethyl)-1-(phenylmethylene)-3H-isoindol-5-yl]phenol IUPAC Name: 2-[(1E)-2-(benzenesulfonyl)-6-benzyl-1-benzylidene-3H-isoindol-5-yl]phenol Traditional Name: 2-[(1E)-1-benzal-6-benzyl-2-besyl-isoindolin-5-yl]phenol Formula: C34H27NO3S MolecularWeight: 529.64808

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C(=C2)C3=CC=CC=C3O)CC4=CC=CC=C4)C(=CC5=CC=CC=C5)N1S(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

C1C2=C(C=C(C(=C2)C3=CC=CC=C3O)CC4=CC=CC=C4)/C(=C\C5=CC=CC=C5)/N1S(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C34H27NO3S/c36-34-19-11-10-18-30(34)31-23-28-24-35(39(37,38)29-16-8-3-9-17-29)33(21-26-14-6-2-7-15-26)32(28)22-27(31)20-25-12-4-1-5-13-25/h1-19,21-23,36H,20,24H2/b33-21+