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

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)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-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)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-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)OCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)OCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O5/c24-18-10-11-26-16-9-5-4-8-15(16)23(18)12-19(25)27-13-17-21-20(22-28-17)14-6-2-1-3-7-14/h1-9H,10-13H2