N-[2-(3-nitropyrazol-1-yl)ethyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-[2-(3-nitropyrazol-1-yl)ethyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[2-(3-nitropyrazol-1-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[2-(3-nitro-1-pyrazolyl)ethyl]-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[2-(3-nitropyrazol-1-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-N-[2-(3-nitropyrazol-1-yl)ethyl]benzenesulfonamide Formula: C15H17N5O5S MolecularWeight: 379.39098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NCCN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NCCN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O5S/c21-15-2-1-9-19(15)12-3-5-13(6-4-12)26(24,25)16-8-11-18-10-7-14(17-18)20(22)23/h3-7,10,16H,1-2,8-9,11H2