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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-ethyl-5-oxidanylidene-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(3-ethyl-5-oxo-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)acetamide Traditional Name: N-(3-ethyl-5-keto-3,4-dihydro-2H-1,4-benzoxazepin-7-yl)-2-phthalimido-acetamide Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC2=C(C=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O)C(=O)N1

Isomeric SMILES

CCC1COC2=C(C=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O)C(=O)N1

InChI

InChI=1S/C21H19N3O5/c1-2-12-11-29-17-8-7-13(9-16(17)19(26)23-12)22-18(25)10-24-20(27)14-5-3-4-6-15(14)21(24)28/h3-9,12H,2,10-11H2,1H3,(H,22,25)(H,23,26)