N-cyclopropyl-1-[4-(dimethylsulfamoyl)-2-nitro-phenyl]sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-cyclopropyl-1-[4-(dimethylsulfamoyl)-2-nitro-phenyl]sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-cyclopropyl-1-[4-(dimethylsulfamoyl)-2-nitro-phenyl]sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-cyclopropyl-1-[4-(dimethylsulfamoyl)-2-nitrophenyl]sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-cyclopropyl-1-[4-(dimethylsulfamoyl)-2-nitrophenyl]sulfonylpyrrolidine-2-carboxamide Traditional Name: N-cyclopropyl-1-[4-(dimethylsulfamoyl)-2-nitro-phenyl]sulfonyl-pyrrolidine-2-carboxamide Formula: C16H22N4O7S2 MolecularWeight: 446.49848

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O7S2/c1-18(2)28(24,25)12-7-8-15(14(10-12)20(22)23)29(26,27)19-9-3-4-13(19)16(21)17-11-5-6-11/h7-8,10-11,13H,3-6,9H2,1-2H3,(H,17,21)