cyanomethyl 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate

Systemtic Name: cyanomethyl 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate Openeye Name: cyanomethyl 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate CAS Name: 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetate Traditional Name: 2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetic acid cyanomethyl ester Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)OCC#N

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)OCC#N

InChI

InChI=1S/C13H12N2O4/c14-6-8-19-13(17)9-15-10-3-1-2-4-11(10)18-7-5-12(15)16/h1-4H,5,7-9H2