2-[(1E)-6-methoxy-1-(phenylmethylidene)-2-(phenylsulfonyl)-3H-isoindol-5-yl]phenol

Systemtic Name: 2-[(1E)-6-methoxy-1-(phenylmethylidene)-2-(phenylsulfonyl)-3H-isoindol-5-yl]phenol Openeye Name: 2-[(1E)-2-(benzenesulfonyl)-1-benzylidene-6-methoxy-isoindolin-5-yl]phenol CAS Name: 2-[(1E)-2-(benzenesulfonyl)-6-methoxy-1-(phenylmethylene)-3H-isoindol-5-yl]phenol IUPAC Name: 2-[(1E)-2-(benzenesulfonyl)-1-benzylidene-6-methoxy-3H-isoindol-5-yl]phenol Traditional Name: 2-[(1E)-1-benzal-2-besyl-6-methoxy-isoindolin-5-yl]phenol Formula: C28H23NO4S MolecularWeight: 469.55152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CN(C2=CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C=C1C5=CC=CC=C5O

Isomeric SMILES

COC1=CC\2=C(CN(/C2=C/C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C=C1C5=CC=CC=C5O

InChI

InChI=1S/C28H23NO4S/c1-33-28-18-24-21(17-25(28)23-14-8-9-15-27(23)30)19-29(26(24)16-20-10-4-2-5-11-20)34(31,32)22-12-6-3-7-13-22/h2-18,30H,19H2,1H3/b26-16+