2,2-bis(fluoranyl)ethyl (2-but-3-enyl-4,6-dinitro-phenyl) carbonate

Systemtic Name: 2,2-bis(fluoranyl)ethyl (2-but-3-enyl-4,6-dinitro-phenyl) carbonate Openeye Name: (2-but-3-enyl-4,6-dinitro-phenyl) 2,2-difluoroethyl carbonate CAS Name: carbonic acid (2-but-3-enyl-4,6-dinitrophenyl) 2,2-difluoroethyl ester IUPAC Name: (2-but-3-enyl-4,6-dinitrophenyl) 2,2-difluoroethyl carbonate Traditional Name: carbonic acid (2-but-3-enyl-4,6-dinitro-phenyl) 2,2-difluoroethyl ester Formula: C13H12F2N2O7 MolecularWeight: 346.240386

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC1=CC(=CC(=C1OC(=O)OCC(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C=CCCC1=CC(=CC(=C1OC(=O)OCC(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H12F2N2O7/c1-2-3-4-8-5-9(16(19)20)6-10(17(21)22)12(8)24-13(18)23-7-11(14)15/h2,5-6,11H,1,3-4,7H2