ethyl 3-acetyloxy-5-(diethylamino)-4,4-bis(fluoranyl)-2-nitro-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 3-acetyloxy-5-(diethylamino)-4,4-bis(fluoranyl)-2-nitro-5-oxidanylidene-pentanoate Openeye Name: ethyl 3-acetoxy-5-(diethylamino)-4,4-difluoro-2-nitro-5-oxo-pentanoate CAS Name: 3-acetyloxy-5-(diethylamino)-4,4-difluoro-2-nitro-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 3-acetyloxy-5-(diethylamino)-4,4-difluoro-2-nitro-5-oxopentanoate Traditional Name: 3-acetoxy-5-(diethylamino)-4,4-difluoro-5-keto-2-nitro-valeric acid ethyl ester Formula: C13H20F2N2O7 MolecularWeight: 354.303906

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C(C(C(=O)OCC)[N+](=O)[O-])OC(=O)C)(F)F

Isomeric SMILES

CCN(CC)C(=O)C(C(C(C(=O)OCC)[N+](=O)[O-])OC(=O)C)(F)F

InChI

InChI=1S/C13H20F2N2O7/c1-5-16(6-2)12(20)13(14,15)10(24-8(4)18)9(17(21)22)11(19)23-7-3/h9-10H,5-7H2,1-4H3