N-butyl-4-morpholin-4-yl-3-nitro-benzenesulfonamide

Systemtic Name: N-butyl-4-morpholin-4-yl-3-nitro-benzenesulfonamide Openeye Name: N-butyl-4-morpholino-3-nitro-benzenesulfonamide CAS Name: N-butyl-4-(4-morpholinyl)-3-nitrobenzenesulfonamide IUPAC Name: N-butyl-4-morpholin-4-yl-3-nitrobenzenesulfonamide Traditional Name: N-butyl-4-morpholino-3-nitro-benzenesulfonamide Formula: C14H21N3O5S MolecularWeight: 343.39864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O5S/c1-2-3-6-15-23(20,21)12-4-5-13(14(11-12)17(18)19)16-7-9-22-10-8-16/h4-5,11,15H,2-3,6-10H2,1H3