2,5-bis(trifluoromethyl)benzene-1,4-diamine sulfate

Systemtic Name: 2,5-bis(trifluoromethyl)benzene-1,4-diamine sulfate Openeye Name: 2,5-bis(trifluoromethyl)benzene-1,4-diamine sulfate CAS Name: 2,5-bis(trifluoromethyl)benzene-1,4-diamine sulfate IUPAC Name: 2,5-bis(trifluoromethyl)benzene-1,4-diamine sulfate Traditional Name: [4-amino-2,5-bis(trifluoromethyl)phenyl]amine sulfate Formula: C8H6F6N2O4S-2 MolecularWeight: 340.199659

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N)C(F)(F)F)N)C(F)(F)F.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=C(C(=CC(=C1N)C(F)(F)F)N)C(F)(F)F.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C8H6F6N2.H2O4S/c9-7(10,11)3-1-5(15)4(2-6(3)16)8(12,13)14;1-5(2,3)4/h1-2H,15-16H2;(H2,1,2,3,4)/p-2