2-(2-acetamido-5-ethanoyl-phenoxy)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide

Systemtic Name: 2-(2-acetamido-5-ethanoyl-phenoxy)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide Openeye Name: 2-(2-acetamido-5-acetyl-phenoxy)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: 2-(2-acetamido-5-acetylphenoxy)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide IUPAC Name: 2-(2-acetamido-5-acetylphenoxy)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-(2-acetamido-5-acetyl-phenoxy)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NC(=O)C)OCC(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NC(=O)C)OCC(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C21H22N2O6/c1-13(24)15-4-6-17(22-14(2)25)19(10-15)29-12-21(26)23-16-5-7-18-20(11-16)28-9-3-8-27-18/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,22,25)(H,23,26)