3-nitro-5-[2,2,2-tris(fluoranyl)ethylsulfonyl]benzene-1,2-diamine

Systemtic Name: 3-nitro-5-[2,2,2-tris(fluoranyl)ethylsulfonyl]benzene-1,2-diamine Openeye Name: 3-nitro-5-(2,2,2-trifluoroethylsulfonyl)benzene-1,2-diamine CAS Name: 3-nitro-5-(2,2,2-trifluoroethylsulfonyl)benzene-1,2-diamine IUPAC Name: 3-nitro-5-(2,2,2-trifluoroethylsulfonyl)benzene-1,2-diamine Traditional Name: [2-amino-3-nitro-5-(2,2,2-trifluoroethylsulfonyl)phenyl]amine Formula: C8H8F3N3O4S MolecularWeight: 299.22703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8F3N3O4S/c9-8(10,11)3-19(17,18)4-1-5(12)7(13)6(2-4)14(15)16/h1-2H,3,12-13H2