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

Systemtic Name: phenyl (3Z)-6-(2-hydroxyphenyl)-2-methoxy-3-(phenylmethylidene)-1H-isoindole-5-sulfonate Openeye Name: phenyl (3Z)-3-benzylidene-6-(2-hydroxyphenyl)-2-methoxy-isoindoline-5-sulfonate CAS Name: (3Z)-6-(2-hydroxyphenyl)-2-methoxy-3-(phenylmethylene)-1H-isoindole-5-sulfonic acid phenyl ester IUPAC Name: phenyl (3Z)-3-benzylidene-6-(2-hydroxyphenyl)-2-methoxy-1H-isoindole-5-sulfonate Traditional Name: (3Z)-3-benzal-6-(2-hydroxyphenyl)-2-methoxy-isoindoline-5-sulfonic acid phenyl ester Formula: C28H23NO5S MolecularWeight: 485.55092

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Descriptors Computed from Structure

Canonical SMILES:

CON1CC2=C(C1=CC3=CC=CC=C3)C=C(C(=C2)C4=CC=CC=C4O)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

CON\1CC2=C(/C1=C/C3=CC=CC=C3)C=C(C(=C2)C4=CC=CC=C4O)S(=O)(=O)OC5=CC=CC=C5

InChI

InChI=1S/C28H23NO5S/c1-33-29-19-21-17-25(23-14-8-9-15-27(23)30)28(35(31,32)34-22-12-6-3-7-13-22)18-24(21)26(29)16-20-10-4-2-5-11-20/h2-18,30H,19H2,1H3/b26-16-