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

Systemtic Name: N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[4-[(2-methoxy-1-methyl-ethyl)sulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[4-[(2-methoxy-1-methyl-ethyl)sulfamoyl]phenyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C19H24N2O7S2 MolecularWeight: 456.53306

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(COC)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H24N2O7S2/c1-14(13-26-2)20-29(22,23)16-6-4-15(5-7-16)21-30(24,25)17-8-9-18-19(12-17)28-11-3-10-27-18/h4-9,12,14,20-21H,3,10-11,13H2,1-2H3