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

Systemtic Name: 4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)ethanoylamino]-N-methyl-benzamide Openeye Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)acetyl]amino]-N-methyl-benzamide CAS Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)acetyl]amino]-N-methylbenzamide Traditional Name: 4-[[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)acetyl]amino]-N-methyl-benzamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CNS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H21N3O6S/c1-20-19(24)13-3-5-14(6-4-13)22-18(23)12-21-29(25,26)15-7-8-16-17(11-15)28-10-2-9-27-16/h3-8,11,21H,2,9-10,12H2,1H3,(H,20,24)(H,22,23)