2-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide

Systemtic Name: 2-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Openeye Name: 2-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide CAS Name: 2-nitro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 2-nitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 2-nitro-N-(4-pyrrolidinosulfonylphenyl)benzenesulfonamide Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O6S2/c20-19(21)15-5-1-2-6-16(15)26(22,23)17-13-7-9-14(10-8-13)27(24,25)18-11-3-4-12-18/h1-2,5-10,17H,3-4,11-12H2