S-ethyl N,N-bis(2-fluoranyl-2,2-dinitro-ethyl)carbamothioate

Systemtic Name: S-ethyl N,N-bis(2-fluoranyl-2,2-dinitro-ethyl)carbamothioate Openeye Name: S-ethyl N,N-bis(2-fluoro-2,2-dinitro-ethyl)carbamothioate CAS Name: N,N-bis(2-fluoro-2,2-dinitroethyl)carbamothioic acid S-ethyl ester IUPAC Name: S-ethyl N,N-bis(2-fluoro-2,2-dinitroethyl)carbamothioate Traditional Name: N,N-bis(2-fluoro-2,2-dinitro-ethyl)thiocarbamic acid S-ethyl ester Formula: C7H9F2N5O9S MolecularWeight: 377.236266

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)N(CC([N+](=O)[O-])([N+](=O)[O-])F)CC([N+](=O)[O-])([N+](=O)[O-])F

Isomeric SMILES

CCSC(=O)N(CC([N+](=O)[O-])([N+](=O)[O-])F)CC([N+](=O)[O-])([N+](=O)[O-])F

InChI

InChI=1S/C7H9F2N5O9S/c1-2-24-5(15)10(3-6(8,11(16)17)12(18)19)4-7(9,13(20)21)14(22)23/h2-4H2,1H3