phenyl (1E)-2-(2-hydroxyphenyl)-1-(phenylmethylidene)-6-(phenylsulfonyl)-3H-isoindole-5-sulfonate

Systemtic Name: phenyl (1E)-2-(2-hydroxyphenyl)-1-(phenylmethylidene)-6-(phenylsulfonyl)-3H-isoindole-5-sulfonate Openeye Name: phenyl (1E)-6-(benzenesulfonyl)-1-benzylidene-2-(2-hydroxyphenyl)isoindoline-5-sulfonate CAS Name: (1E)-6-(benzenesulfonyl)-2-(2-hydroxyphenyl)-1-(phenylmethylene)-3H-isoindole-5-sulfonic acid phenyl ester IUPAC Name: phenyl (1E)-6-(benzenesulfonyl)-1-benzylidene-2-(2-hydroxyphenyl)-3H-isoindole-5-sulfonate Traditional Name: (1E)-1-benzal-6-besyl-2-(2-hydroxyphenyl)isoindoline-5-sulfonic acid phenyl ester Formula: C33H25NO6S2 MolecularWeight: 595.6847

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=C(C=C2C(=CC3=CC=CC=C3)N1C4=CC=CC=C4O)S(=O)(=O)C5=CC=CC=C5)S(=O)(=O)OC6=CC=CC=C6

Isomeric SMILES

C1C2=CC(=C(C=C2/C(=C\C3=CC=CC=C3)/N1C4=CC=CC=C4O)S(=O)(=O)C5=CC=CC=C5)S(=O)(=O)OC6=CC=CC=C6

InChI

InChI=1S/C33H25NO6S2/c35-31-19-11-10-18-29(31)34-23-25-21-33(42(38,39)40-26-14-6-2-7-15-26)32(41(36,37)27-16-8-3-9-17-27)22-28(25)30(34)20-24-12-4-1-5-13-24/h1-22,35H,23H2/b30-20+