diethyl 2,4-bis[(2-fluoranyl-2,2-dinitro-ethyl)amino]pentanedioate

Systemtic Name: diethyl 2,4-bis[(2-fluoranyl-2,2-dinitro-ethyl)amino]pentanedioate Openeye Name: diethyl 2,4-bis[(2-fluoro-2,2-dinitro-ethyl)amino]pentanedioate CAS Name: 2,4-bis[(2-fluoro-2,2-dinitroethyl)amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2,4-bis[(2-fluoro-2,2-dinitroethyl)amino]pentanedioate Traditional Name: 2,4-bis[(2-fluoro-2,2-dinitro-ethyl)amino]glutaric acid diethyl ester Formula: C13H20F2N6O12 MolecularWeight: 490.327706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C(=O)OCC)NCC([N+](=O)[O-])([N+](=O)[O-])F)NCC([N+](=O)[O-])([N+](=O)[O-])F

Isomeric SMILES

CCOC(=O)C(CC(C(=O)OCC)NCC([N+](=O)[O-])([N+](=O)[O-])F)NCC([N+](=O)[O-])([N+](=O)[O-])F

InChI

InChI=1S/C13H20F2N6O12/c1-3-32-10(22)8(16-6-12(14,18(24)25)19(26)27)5-9(11(23)33-4-2)17-7-13(15,20(28)29)21(30)31/h8-9,16-17H,3-7H2,1-2H3