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

Systemtic Name: 2-[(1E)-6-(2-hydroxyphenyl)-1-(phenylmethylidene)-2-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol Openeye Name: 2-[(1E)-1-benzylidene-6-(2-hydroxyphenyl)-2-isopropylsulfonyl-isoindolin-5-yl]phenol CAS Name: 2-[(1E)-6-(2-hydroxyphenyl)-1-(phenylmethylene)-2-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol IUPAC Name: 2-[(1E)-1-benzylidene-6-(2-hydroxyphenyl)-2-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol Traditional Name: 2-[(1E)-1-benzal-6-(2-hydroxyphenyl)-2-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)N1CC2=C(C1=CC3=CC=CC=C3)C=C(C(=C2)C4=CC=CC=C4O)C5=CC=CC=C5O

Isomeric SMILES

CC(C)S(=O)(=O)N\1CC2=C(/C1=C\C3=CC=CC=C3)C=C(C(=C2)C4=CC=CC=C4O)C5=CC=CC=C5O

InChI

InChI=1S/C30H27NO4S/c1-20(2)36(34,35)31-19-22-17-26(23-12-6-8-14-29(23)32)27(24-13-7-9-15-30(24)33)18-25(22)28(31)16-21-10-4-3-5-11-21/h3-18,20,32-33H,19H2,1-2H3/b28-16+