diphenyl (3Z)-2-ethoxy-3-(phenylmethylidene)-1H-isoindole-5,6-disulfonate

Systemtic Name: diphenyl (3Z)-2-ethoxy-3-(phenylmethylidene)-1H-isoindole-5,6-disulfonate Openeye Name: diphenyl (1Z)-1-benzylidene-2-ethoxy-isoindoline-5,6-disulfonate CAS Name: (3Z)-2-ethoxy-3-(phenylmethylene)-1H-isoindole-5,6-disulfonic acid diphenyl ester IUPAC Name: diphenyl (3Z)-3-benzylidene-2-ethoxy-1H-isoindole-5,6-disulfonate Traditional Name: (1Z)-1-benzal-2-ethoxy-isoindoline-5,6-disulfonic acid diphenyl ester Formula: C29H25NO7S2 MolecularWeight: 563.6413

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Descriptors Computed from Structure

Canonical SMILES:

CCON1CC2=CC(=C(C=C2C1=CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4)S(=O)(=O)OC5=CC=CC=C5

Isomeric SMILES

CCON\1CC2=CC(=C(C=C2/C1=C/C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4)S(=O)(=O)OC5=CC=CC=C5

InChI

InChI=1S/C29H25NO7S2/c1-2-35-30-21-23-19-28(38(31,32)36-24-14-8-4-9-15-24)29(39(33,34)37-25-16-10-5-11-17-25)20-26(23)27(30)18-22-12-6-3-7-13-22/h3-20H,2,21H2,1H3/b27-18-