2-(nitromethyl)-1,3,5-tris(trifluoromethylsulfonyl)benzene

Systemtic Name: 2-(nitromethyl)-1,3,5-tris(trifluoromethylsulfonyl)benzene Openeye Name: 2-(nitromethyl)-1,3,5-tris(trifluoromethylsulfonyl)benzene CAS Name: 2-(nitromethyl)-1,3,5-tris(trifluoromethylsulfonyl)benzene IUPAC Name: 2-(nitromethyl)-1,3,5-tris(trifluoromethylsulfonyl)benzene Traditional Name: 2-(nitromethyl)-1,3,5-tritriflyl-benzene Formula: C10H4F9NO8S3 MolecularWeight: 533.321289

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1S(=O)(=O)C(F)(F)F)C[N+](=O)[O-])S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1S(=O)(=O)C(F)(F)F)C[N+](=O)[O-])S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C10H4F9NO8S3/c11-8(12,13)29(23,24)4-1-6(30(25,26)9(14,15)16)5(3-20(21)22)7(2-4)31(27,28)10(17,18)19/h1-2H,3H2