4-fluoranyl-N-(4-morpholin-4-ylphenyl)-2-nitro-benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-(4-morpholin-4-ylphenyl)-2-nitro-benzenesulfonamide Openeye Name: 4-fluoro-N-(4-morpholinophenyl)-2-nitro-benzenesulfonamide CAS Name: 4-fluoro-N-[4-(4-morpholinyl)phenyl]-2-nitrobenzenesulfonamide IUPAC Name: 4-fluoro-N-(4-morpholin-4-ylphenyl)-2-nitrobenzenesulfonamide Traditional Name: 4-fluoro-N-(4-morpholinophenyl)-2-nitro-benzenesulfonamide Formula: C16H16FN3O5S MolecularWeight: 381.378743

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H16FN3O5S/c17-12-1-6-16(15(11-12)20(21)22)26(23,24)18-13-2-4-14(5-3-13)19-7-9-25-10-8-19/h1-6,11,18H,7-10H2