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

Systemtic Name: (3-cyanophenyl)methyl 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate Openeye Name: (3-cyanophenyl)methyl 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 (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 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 (3-cyanobenzyl) ester Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)OCC3=CC=CC(=C3)C#N

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)OCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H16N2O4/c20-11-14-4-3-5-15(10-14)13-25-19(23)12-21-16-6-1-2-7-17(16)24-9-8-18(21)22/h1-7,10H,8-9,12-13H2