3,4-diethoxy-N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)benzenesulfonamide

Systemtic Name: 3,4-diethoxy-N-(4-fluoranyl-3-morpholin-4-ylsulfonyl-phenyl)benzenesulfonamide Openeye Name: 3,4-diethoxy-N-(4-fluoro-3-morpholinosulfonyl-phenyl)benzenesulfonamide CAS Name: 3,4-diethoxy-N-[4-fluoro-3-(4-morpholinylsulfonyl)phenyl]benzenesulfonamide IUPAC Name: 3,4-diethoxy-N-(4-fluoro-3-morpholin-4-ylsulfonylphenyl)benzenesulfonamide Traditional Name: 3,4-diethoxy-N-(4-fluoro-3-morpholinosulfonyl-phenyl)benzenesulfonamide Formula: C20H25FN2O7S2 MolecularWeight: 488.550103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)F)S(=O)(=O)N3CCOCC3)OCC

InChI

InChI=1S/C20H25FN2O7S2/c1-3-29-18-8-6-16(14-19(18)30-4-2)31(24,25)22-15-5-7-17(21)20(13-15)32(26,27)23-9-11-28-12-10-23/h5-8,13-14,22H,3-4,9-12H2,1-2H3