N-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-2-(phenylsulfonylamino)ethanamide

Systemtic Name: N-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]-2-(phenylsulfonylamino)ethanamide Openeye Name: 2-(benzenesulfonamido)-N-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]acetamide CAS Name: 2-(benzenesulfonamido)-N-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]acetamide IUPAC Name: 2-(benzenesulfonamido)-N-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]acetamide Traditional Name: 2-(benzenesulfonamido)-N-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]acetamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CNS(=O)(=O)C1=CC=CC=C1)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5S/c1-14(15-8-9-17-18(12-15)27-11-5-10-26-17)21-22-19(23)13-20-28(24,25)16-6-3-2-4-7-16/h2-4,6-9,12,20H,5,10-11,13H2,1H3,(H,22,23)/b21-14-