N4,N4-diethyl-N1-(3-sulfamoylphenyl)benzene-1,4-disulfonamide

Systemtic Name: N4,N4-diethyl-N1-(3-sulfamoylphenyl)benzene-1,4-disulfonamide Openeye Name: N4,N4-diethyl-N1-(3-sulfamoylphenyl)benzene-1,4-disulfonamide CAS Name: N4,N4-diethyl-N1-(3-sulfamoylphenyl)benzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-diethyl-1-N-(3-sulfamoylphenyl)benzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-(3-sulfamoylphenyl)benzene-1,4-disulfonamide Formula: C16H21N3O6S3 MolecularWeight: 447.54944

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)N

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C16H21N3O6S3/c1-3-19(4-2)28(24,25)15-10-8-14(9-11-15)27(22,23)18-13-6-5-7-16(12-13)26(17,20)21/h5-12,18H,3-4H2,1-2H3,(H2,17,20,21)