4-(sulfonylamino)butane-1-sulfonic acid; 2-(trifluoromethyl)aniline

Systemtic Name: 4-(sulfonylamino)butane-1-sulfonic acid; 2-(trifluoromethyl)aniline Openeye Name: 4-(sulfonylamino)butane-1-sulfonic acid; 2-(trifluoromethyl)aniline CAS Name: 4-(sulfonylamino)-1-butanesulfonic acid; 2-(trifluoromethyl)aniline IUPAC Name: 4-(sulfonylamino)butane-1-sulfonic acid; 2-(trifluoromethyl)aniline Traditional Name: 4-(sulfonylamino)butane-1-sulfonic acid; [2-(trifluoromethyl)phenyl]amine Formula: C11H15F3N2O5S2 MolecularWeight: 376.37241

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)N.C(CCS(=O)(=O)O)CN=S(=O)=O

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)N.C(CCS(=O)(=O)O)CN=S(=O)=O

InChI

InChI=1S/C7H6F3N.C4H9NO5S2/c8-7(9,10)5-3-1-2-4-6(5)11;6-11(7)5-3-1-2-4-12(8,9)10/h1-4H,11H2;1-4H2,(H,8,9,10)