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

Systemtic Name: N-[3-[(3-chlorophenyl)sulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[3-[(3-chlorophenyl)sulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[3-[(3-chlorophenyl)sulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[3-[(3-chlorophenyl)sulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[3-[(3-chlorophenyl)sulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C21H19ClN2O6S2 MolecularWeight: 494.96836

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=CC(=CC=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=CC=C3)S(=O)(=O)NC4=CC(=CC=C4)Cl)OC1

InChI

InChI=1S/C21H19ClN2O6S2/c22-15-4-1-5-16(12-15)23-31(25,26)18-7-2-6-17(13-18)24-32(27,28)19-8-9-20-21(14-19)30-11-3-10-29-20/h1-2,4-9,12-14,23-24H,3,10-11H2