N-tert-butyl-3-nitro-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-[3-(2-oxopyrrolidin-1-yl)propylamino]benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-[3-(2-oxo-1-pyrrolidinyl)propylamino]benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-[3-(2-oxopyrrolidin-1-yl)propylamino]benzenesulfonamide Traditional Name: N-tert-butyl-4-[3-(2-ketopyrrolidino)propylamino]-3-nitro-benzenesulfonamide Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCCN2CCCC2=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCCN2CCCC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O5S/c1-17(2,3)19-27(25,26)13-7-8-14(15(12-13)21(23)24)18-9-5-11-20-10-4-6-16(20)22/h7-8,12,18-19H,4-6,9-11H2,1-3H3