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

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-pentyl-benzamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-pentyl-benzamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-pentylbenzamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-pentylbenzamide Traditional Name: N-amyl-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5S/c1-2-3-4-12-22-21(24)16-6-8-17(9-7-16)23-29(25,26)18-10-11-19-20(15-18)28-14-5-13-27-19/h6-11,15,23H,2-5,12-14H2,1H3,(H,22,24)