N-ethyl-4-methylsulfonyl-2,6-dinitro-N-[2,2,3,3-tetrakis(fluoranyl)propyl]aniline

Systemtic Name: N-ethyl-4-methylsulfonyl-2,6-dinitro-N-[2,2,3,3-tetrakis(fluoranyl)propyl]aniline Openeye Name: N-ethyl-4-methylsulfonyl-2,6-dinitro-N-(2,2,3,3-tetrafluoropropyl)aniline CAS Name: N-ethyl-4-methylsulfonyl-2,6-dinitro-N-(2,2,3,3-tetrafluoropropyl)aniline IUPAC Name: N-ethyl-4-methylsulfonyl-2,6-dinitro-N-(2,2,3,3-tetrafluoropropyl)aniline Traditional Name: ethyl-(4-mesyl-2,6-dinitro-phenyl)-(2,2,3,3-tetrafluoropropyl)amine Formula: C12H13F4N3O6S MolecularWeight: 403.306733

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(C(F)F)(F)F)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(C(F)F)(F)F)C1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H13F4N3O6S/c1-3-17(6-12(15,16)11(13)14)10-8(18(20)21)4-7(26(2,24)25)5-9(10)19(22)23/h4-5,11H,3,6H2,1-2H3