N-[2,4-bis(fluoranyl)-5-nitro-phenyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[2,4-bis(fluoranyl)-5-nitro-phenyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide Openeye Name: N-(2,4-difluoro-5-nitro-phenyl)-4-morpholinosulfonyl-benzenesulfonamide CAS Name: N-(2,4-difluoro-5-nitrophenyl)-4-(4-morpholinylsulfonyl)benzenesulfonamide IUPAC Name: N-(2,4-difluoro-5-nitrophenyl)-4-morpholin-4-ylsulfonylbenzenesulfonamide Traditional Name: N-(2,4-difluoro-5-nitro-phenyl)-4-morpholinosulfonyl-benzenesulfonamide Formula: C16H15F2N3O7S2 MolecularWeight: 463.433006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3F)F)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H15F2N3O7S2/c17-13-9-14(18)16(21(22)23)10-15(13)19-29(24,25)11-1-3-12(4-2-11)30(26,27)20-5-7-28-8-6-20/h1-4,9-10,19H,5-8H2