2-nitro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide

Systemtic Name: 2-nitro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Openeye Name: 2-nitro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide CAS Name: 2-nitro-N-[3-(1-pyrrolidinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 2-nitro-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 2-nitro-N-(3-pyrrolidinosulfonylphenyl)benzenesulfonamide Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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