2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide

Systemtic Name: 2-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamide Openeye Name: 2-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: 2-(5-bromo-1,3-dioxo-2-isoindolyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide IUPAC Name: 2-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C19H15BrN2O5 MolecularWeight: 431.2368

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)Br)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)Br)OC1

InChI

InChI=1S/C19H15BrN2O5/c20-11-2-4-13-14(8-11)19(25)22(18(13)24)10-17(23)21-12-3-5-15-16(9-12)27-7-1-6-26-15/h2-5,8-9H,1,6-7,10H2,(H,21,23)