N-(2-morpholin-4-ylpropyl)-4-nitro-benzenesulfonamide

Systemtic Name: N-(2-morpholin-4-ylpropyl)-4-nitro-benzenesulfonamide Openeye Name: N-(2-morpholinopropyl)-4-nitro-benzenesulfonamide CAS Name: N-[2-(4-morpholinyl)propyl]-4-nitrobenzenesulfonamide IUPAC Name: N-(2-morpholin-4-ylpropyl)-4-nitrobenzenesulfonamide Traditional Name: N-(2-morpholinopropyl)-4-nitro-benzenesulfonamide Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])N2CCOCC2

Isomeric SMILES

CC(CNS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])N2CCOCC2

InChI

InChI=1S/C13H19N3O5S/c1-11(15-6-8-21-9-7-15)10-14-22(19,20)13-4-2-12(3-5-13)16(17)18/h2-5,11,14H,6-10H2,1H3