4-chloranyl-3-nitro-N-[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-3-nitro-N-[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]benzenesulfonamide Openeye Name: 4-chloro-3-nitro-N-[3-(2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]benzenesulfonamide CAS Name: 4-chloro-3-nitro-N-[3-[2-oxo-2-(1-pyrrolidinyl)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 4-chloro-3-nitro-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-(2-keto-2-pyrrolidino-ethoxy)phenyl]-3-nitro-benzenesulfonamide Formula: C18H18ClN3O6S MolecularWeight: 439.87002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC2=CC=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)COC2=CC=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O6S/c19-16-7-6-15(11-17(16)22(24)25)29(26,27)20-13-4-3-5-14(10-13)28-12-18(23)21-8-1-2-9-21/h3-7,10-11,20H,1-2,8-9,12H2