N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzenesulfonamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzenesulfonamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-2-nitrobenzenesulfonamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitrobenzenesulfonamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-nitro-benzenesulfonamide Formula: C13H20N3O5S+ MolecularWeight: 330.38

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O5S/c17-16(18)12-4-1-2-5-13(12)22(19,20)14-6-3-7-15-8-10-21-11-9-15/h1-2,4-5,14H,3,6-11H2/p+1