(1E)-1-(phenylmethylidene)-2,6-bis(propan-2-ylsulfonyl)-3H-isoindol-5-ol

Systemtic Name: (1E)-1-(phenylmethylidene)-2,6-bis(propan-2-ylsulfonyl)-3H-isoindol-5-ol Openeye Name: (1E)-1-benzylidene-2,6-bis(isopropylsulfonyl)isoindolin-5-ol CAS Name: (1E)-1-(phenylmethylene)-2,6-bis(propan-2-ylsulfonyl)-3H-isoindol-5-ol IUPAC Name: (1E)-1-benzylidene-2,6-bis(propan-2-ylsulfonyl)-3H-isoindol-5-ol Traditional Name: (1E)-1-benzal-2,6-bis(isopropylsulfonyl)isoindolin-5-ol Formula: C21H25NO5S2 MolecularWeight: 435.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=C2CN(C(=CC3=CC=CC=C3)C2=C1)S(=O)(=O)C(C)C)O

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=C2CN(/C(=C/C3=CC=CC=C3)/C2=C1)S(=O)(=O)C(C)C)O

InChI

InChI=1S/C21H25NO5S2/c1-14(2)28(24,25)21-12-18-17(11-20(21)23)13-22(29(26,27)15(3)4)19(18)10-16-8-6-5-7-9-16/h5-12,14-15,23H,13H2,1-4H3/b19-10+