[4-(diethylsulfamoyl)-2-nitro-phenyl] (E)-2-phenylethenesulfonate

Systemtic Name: [4-(diethylsulfamoyl)-2-nitro-phenyl] (E)-2-phenylethenesulfonate Openeye Name: [4-(diethylsulfamoyl)-2-nitro-phenyl] (E)-2-phenylethenesulfonate CAS Name: (E)-2-phenylethenesulfonic acid [4-(diethylsulfamoyl)-2-nitrophenyl] ester IUPAC Name: [4-(diethylsulfamoyl)-2-nitrophenyl] (E)-2-phenylethenesulfonate Traditional Name: (E)-2-phenylethenesulfonic acid [4-(diethylsulfamoyl)-2-nitro-phenyl] ester Formula: C18H20N2O7S2 MolecularWeight: 440.4906

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OS(=O)(=O)C=CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OS(=O)(=O)/C=C/C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O7S2/c1-3-19(4-2)29(25,26)16-10-11-18(17(14-16)20(21)22)27-28(23,24)13-12-15-8-6-5-7-9-15/h5-14H,3-4H2,1-2H3/b13-12+