3-[4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]phenyl]propanoate

Systemtic Name: 3-[4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]phenyl]propanoate Openeye Name: 3-[4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]phenyl]propanoate CAS Name: 3-[4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]phenyl]propanoate IUPAC Name: 3-[4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]phenyl]propanoate Traditional Name: 3-[4-[[5-(diethylsulfamoyl)-2-(propylamino)phenyl]sulfamoyl]phenyl]propionate Formula: C22H30N3O6S2- MolecularWeight: 496.6201

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)[O-]

Isomeric SMILES

CCCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=CC=C(C=C2)CCC(=O)[O-]

InChI

InChI=1S/C22H31N3O6S2/c1-4-15-23-20-13-12-19(33(30,31)25(5-2)6-3)16-21(20)24-32(28,29)18-10-7-17(8-11-18)9-14-22(26)27/h7-8,10-13,16,23-24H,4-6,9,14-15H2,1-3H3,(H,26,27)/p-1