N-methyl-3-nitro-4-[(4-sulfamoylphenyl)methylamino]benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-4-[(4-sulfamoylphenyl)methylamino]benzenesulfonamide Openeye Name: N-methyl-3-nitro-4-[(4-sulfamoylphenyl)methylamino]benzenesulfonamide CAS Name: N-methyl-3-nitro-4-[(4-sulfamoylphenyl)methylamino]benzenesulfonamide IUPAC Name: N-methyl-3-nitro-4-[(4-sulfamoylphenyl)methylamino]benzenesulfonamide Traditional Name: N-methyl-3-nitro-4-[(4-sulfamoylbenzyl)amino]benzenesulfonamide Formula: C14H16N4O6S2 MolecularWeight: 400.43004

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O6S2/c1-16-26(23,24)12-6-7-13(14(8-12)18(19)20)17-9-10-2-4-11(5-3-10)25(15,21)22/h2-8,16-17H,9H2,1H3,(H2,15,21,22)