2-[(1E)-2-(2-hydroxyphenyl)-1-(phenylmethylidene)-6-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol

Systemtic Name: 2-[(1E)-2-(2-hydroxyphenyl)-1-(phenylmethylidene)-6-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol Openeye Name: 2-[(1E)-1-benzylidene-2-(2-hydroxyphenyl)-6-isopropylsulfonyl-isoindolin-5-yl]phenol CAS Name: 2-[(1E)-2-(2-hydroxyphenyl)-1-(phenylmethylene)-6-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol IUPAC Name: 2-[(1E)-1-benzylidene-2-(2-hydroxyphenyl)-6-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol Traditional Name: 2-[(1E)-1-benzal-2-(2-hydroxyphenyl)-6-isopropylsulfonyl-isoindolin-5-yl]phenol Formula: C30H27NO4S MolecularWeight: 497.60468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC2=C(CN(C2=CC3=CC=CC=C3)C4=CC=CC=C4O)C=C1C5=CC=CC=C5O

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC\2=C(CN(/C2=C/C3=CC=CC=C3)C4=CC=CC=C4O)C=C1C5=CC=CC=C5O

InChI

InChI=1S/C30H27NO4S/c1-20(2)36(34,35)30-18-24-22(17-25(30)23-12-6-8-14-28(23)32)19-31(26-13-7-9-15-29(26)33)27(24)16-21-10-4-3-5-11-21/h3-18,20,32-33H,19H2,1-2H3/b27-16+