N-[2-chloranyl-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]ethanamide

Systemtic Name: N-[2-chloranyl-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]ethanamide Openeye Name: N-[2-chloro-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]acetamide CAS Name: N-[2-chloro-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]acetamide IUPAC Name: N-[2-chloro-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]acetamide Traditional Name: N-[2-chloro-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]acetamide Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3)Cl

InChI

InChI=1S/C17H17ClN2O5S/c1-11(21)19-15-5-3-12(9-14(15)18)20-26(22,23)13-4-6-16-17(10-13)25-8-2-7-24-16/h3-6,9-10,20H,2,7-8H2,1H3,(H,19,21)