N-[[2-(dimethylsulfamoyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[[2-(dimethylsulfamoyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[[2-(dimethylsulfamoyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[[2-(dimethylsulfamoyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[[2-(dimethylsulfamoyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[2-(dimethylsulfamoyl)benzyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC=C1CNC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC=C1CNC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H22N2O5S/c1-21(2)27(23,24)18-7-4-3-6-15(18)13-20-19(22)14-8-9-16-17(12-14)26-11-5-10-25-16/h3-4,6-9,12H,5,10-11,13H2,1-2H3,(H,20,22)