[4-(aminomethyl)-2,3,5,6-tetrakis(fluoranyl)phenyl]methanamine disulfate

Systemtic Name: [4-(aminomethyl)-2,3,5,6-tetrakis(fluoranyl)phenyl]methanamine disulfate Openeye Name: [4-(aminomethyl)-2,3,5,6-tetrafluoro-phenyl]methanamine disulfate CAS Name: [4-(aminomethyl)-2,3,5,6-tetrafluorophenyl]methanamine disulfate IUPAC Name: [4-(aminomethyl)-2,3,5,6-tetrafluorophenyl]methanamine disulfate Traditional Name: [4-(aminomethyl)-2,3,5,6-tetrafluoro-benzyl]amine disulfate Formula: C8H8F4N2O8S2-4 MolecularWeight: 400.281333

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Descriptors Computed from Structure

Canonical SMILES:

C(C1=C(C(=C(C(=C1F)F)CN)F)F)N.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-]

Isomeric SMILES

C(C1=C(C(=C(C(=C1F)F)CN)F)F)N.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C8H8F4N2.2H2O4S/c9-5-3(1-13)6(10)8(12)4(2-14)7(5)11;2*1-5(2,3)4/h1-2,13-14H2;2*(H2,1,2,3,4)/p-4