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

Systemtic Name: 2-[(1E)-6-(phenylmethyl)-1-(phenylmethylidene)-2-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol Openeye Name: 2-[(1E)-6-benzyl-1-benzylidene-2-isopropylsulfonyl-isoindolin-5-yl]phenol CAS Name: 2-[(1E)-6-(phenylmethyl)-1-(phenylmethylene)-2-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol IUPAC Name: 2-[(1E)-6-benzyl-1-benzylidene-2-propan-2-ylsulfonyl-3H-isoindol-5-yl]phenol Traditional Name: 2-[(1E)-1-benzal-6-benzyl-2-isopropylsulfonyl-isoindolin-5-yl]phenol Formula: C31H29NO3S MolecularWeight: 495.63186

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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)CC5=CC=CC=C5

Isomeric SMILES

CC(C)S(=O)(=O)N\1CC2=C(/C1=C\C3=CC=CC=C3)C=C(C(=C2)C4=CC=CC=C4O)CC5=CC=CC=C5

InChI

InChI=1S/C31H29NO3S/c1-22(2)36(34,35)32-21-26-20-28(27-15-9-10-16-31(27)33)25(17-23-11-5-3-6-12-23)19-29(26)30(32)18-24-13-7-4-8-14-24/h3-16,18-20,22,33H,17,21H2,1-2H3/b30-18+