phenyl (3Z)-6-(2-hydroxyphenyl)-2-(phenylmethyl)-3-(phenylmethylidene)-1H-isoindole-5-sulfonate

Systemtic Name: phenyl (3Z)-6-(2-hydroxyphenyl)-2-(phenylmethyl)-3-(phenylmethylidene)-1H-isoindole-5-sulfonate Openeye Name: phenyl (3Z)-2-benzyl-3-benzylidene-6-(2-hydroxyphenyl)isoindoline-5-sulfonate CAS Name: (3Z)-6-(2-hydroxyphenyl)-2-(phenylmethyl)-3-(phenylmethylene)-1H-isoindole-5-sulfonic acid phenyl ester IUPAC Name: phenyl (3Z)-2-benzyl-3-benzylidene-6-(2-hydroxyphenyl)-1H-isoindole-5-sulfonate Traditional Name: (3Z)-3-benzal-2-benzyl-6-(2-hydroxyphenyl)isoindoline-5-sulfonic acid phenyl ester Formula: C34H27NO4S MolecularWeight: 545.64748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C(=C2)C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4)C(=CC5=CC=CC=C5)N1CC6=CC=CC=C6

Isomeric SMILES

C1C2=C(C=C(C(=C2)C3=CC=CC=C3O)S(=O)(=O)OC4=CC=CC=C4)/C(=C/C5=CC=CC=C5)/N1CC6=CC=CC=C6

InChI

InChI=1S/C34H27NO4S/c36-33-19-11-10-18-29(33)31-21-27-24-35(23-26-14-6-2-7-15-26)32(20-25-12-4-1-5-13-25)30(27)22-34(31)40(37,38)39-28-16-8-3-9-17-28/h1-22,36H,23-24H2/b32-20-