N-[4-[(4-fluorophenyl)methylsulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[4-[(4-fluorophenyl)methylsulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[4-[(4-fluorophenyl)methylsulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[4-[(4-fluorophenyl)methylsulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[4-[(4-fluorophenyl)methylsulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[4-[(4-fluorobenzyl)sulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C22H21FN2O6S2 MolecularWeight: 492.540343

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=C(C=C4)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=C(C=C4)F)OC1

InChI

InChI=1S/C22H21FN2O6S2/c23-17-4-2-16(3-5-17)15-24-32(26,27)19-8-6-18(7-9-19)25-33(28,29)20-10-11-21-22(14-20)31-13-1-12-30-21/h2-11,14,24-25H,1,12-13,15H2