ethyl 2-[3,3-bis(fluoranyl)-2-oxidanylidene-4,5-dihydroazepin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3,3-bis(fluoranyl)-2-oxidanylidene-4,5-dihydroazepin-1-yl]ethanoate Openeye Name: ethyl 2-(3,3-difluoro-2-oxo-4,5-dihydroazepin-1-yl)acetate CAS Name: 2-(3,3-difluoro-2-oxo-4,5-dihydroazepin-1-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(3,3-difluoro-2-oxo-4,5-dihydroazepin-1-yl)acetate Traditional Name: 2-(3,3-difluoro-2-keto-4,5-dihydroazepin-1-yl)acetic acid ethyl ester Formula: C10H13F2NO3 MolecularWeight: 233.211926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=CCCC(C1=O)(F)F

Isomeric SMILES

CCOC(=O)CN1C=CCCC(C1=O)(F)F

InChI

InChI=1S/C10H13F2NO3/c1-2-16-8(14)7-13-6-4-3-5-10(11,12)9(13)15/h4,6H,2-3,5,7H2,1H3