4-[[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]methyl]-N-methyl-benzamide CAS Name: 4-[[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]methyl]-N-methylbenzamide IUPAC Name: 4-[[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]methyl]-N-methylbenzamide Traditional Name: 4-[[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]methyl]-N-methyl-benzamide Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O5S/c1-20-19(22)15-6-4-14(5-7-15)13-21(2)27(23,24)16-8-9-17-18(12-16)26-11-3-10-25-17/h4-9,12H,3,10-11,13H2,1-2H3,(H,20,22)