3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N,N-diethyl-benzamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N,N-diethyl-benzamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N,N-diethyl-benzamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N,N-diethylbenzamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N,N-diethylbenzamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N,N-diethyl-benzamide Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O5S/c1-3-22(4-2)20(23)15-7-5-8-16(13-15)21-28(24,25)17-9-10-18-19(14-17)27-12-6-11-26-18/h5,7-10,13-14,21H,3-4,6,11-12H2,1-2H3