disodium 5-(2,3-dihydro-1H-isoindol-1-yl)-2-[(E)-2-(4-ethoxy-2-sulfamoyl-phenyl)ethenyl]benzenesulfonamide

Systemtic Name: disodium 5-(2,3-dihydro-1H-isoindol-1-yl)-2-[(E)-2-(4-ethoxy-2-sulfamoyl-phenyl)ethenyl]benzenesulfonamide Openeye Name: disodium 2-[(E)-2-(4-ethoxy-2-sulfamoyl-phenyl)vinyl]-5-isoindolin-1-yl-benzenesulfonamide CAS Name: disodium 5-(2,3-dihydro-1H-isoindol-1-yl)-2-[(E)-2-(4-ethoxy-2-sulfamoylphenyl)ethenyl]benzenesulfonamide IUPAC Name: disodium 5-(2,3-dihydro-1H-isoindol-1-yl)-2-[(E)-2-(4-ethoxy-2-sulfamoylphenyl)ethenyl]benzenesulfonamide Traditional Name: disodium 2-[(E)-2-(4-ethoxy-2-sulfamoyl-phenyl)vinyl]-5-isoindolin-1-yl-benzenesulfonamide Formula: C24H25N3Na2O5S2+2 MolecularWeight: 545.58194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C=CC2=C(C=C(C=C2)C3C4=CC=CC=C4CN3)S(=O)(=O)N)S(=O)(=O)N.[Na+].[Na+]

Isomeric SMILES

CCOC1=CC(=C(C=C1)/C=C/C2=C(C=C(C=C2)C3C4=CC=CC=C4CN3)S(=O)(=O)N)S(=O)(=O)N.[Na+].[Na+]

InChI

InChI=1S/C24H25N3O5S2.2Na/c1-2-32-20-12-11-17(23(14-20)34(26,30)31)8-7-16-9-10-18(13-22(16)33(25,28)29)24-21-6-4-3-5-19(21)15-27-24;;/h3-14,24,27H,2,15H2,1H3,(H2,25,28,29)(H2,26,30,31);;/q;2*+1/b8-7+;;