2-nitro-N-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)phenyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)phenyl]benzenesulfonamide Openeye Name: 2-nitro-N-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)phenyl]benzenesulfonamide CAS Name: 2-nitro-N-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]phenyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[4-(2-oxo-2-pyrrolidin-1-ylethyl)phenyl]benzenesulfonamide Traditional Name: N-[4-(2-keto-2-pyrrolidino-ethyl)phenyl]-2-nitro-benzenesulfonamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c22-18(20-11-3-4-12-20)13-14-7-9-15(10-8-14)19-27(25,26)17-6-2-1-5-16(17)21(23)24/h1-2,5-10,19H,3-4,11-13H2