N,N-diethyl-4-[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]piperazine-1-sulfonamide

Systemtic Name: N,N-diethyl-4-[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]piperazine-1-sulfonamide Openeye Name: N,N-diethyl-4-[4-(isopropylsulfamoyl)-2-nitro-phenyl]piperazine-1-sulfonamide CAS Name: N,N-diethyl-4-[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]-1-piperazinesulfonamide IUPAC Name: N,N-diethyl-4-[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]piperazine-1-sulfonamide Traditional Name: N,N-diethyl-4-[4-(isopropylsulfamoyl)-2-nitro-phenyl]piperazine-1-sulfonamide Formula: C17H29N5O6S2 MolecularWeight: 463.57206

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H29N5O6S2/c1-5-20(6-2)30(27,28)21-11-9-19(10-12-21)16-8-7-15(13-17(16)22(23)24)29(25,26)18-14(3)4/h7-8,13-14,18H,5-6,9-12H2,1-4H3