[3,4-bis(azanyl)phenyl] 3-(trifluoromethyl)benzenesulfonate

Systemtic Name: [3,4-bis(azanyl)phenyl] 3-(trifluoromethyl)benzenesulfonate Openeye Name: (3,4-diaminophenyl) 3-(trifluoromethyl)benzenesulfonate CAS Name: 3-(trifluoromethyl)benzenesulfonic acid (3,4-diaminophenyl) ester IUPAC Name: (3,4-diaminophenyl) 3-(trifluoromethyl)benzenesulfonate Traditional Name: 3-(trifluoromethyl)benzenesulfonic acid (3,4-diaminophenyl) ester Formula: C13H11F3N2O3S MolecularWeight: 332.29825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC(=C(C=C2)N)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)OC2=CC(=C(C=C2)N)N)C(F)(F)F

InChI

InChI=1S/C13H11F3N2O3S/c14-13(15,16)8-2-1-3-10(6-8)22(19,20)21-9-4-5-11(17)12(18)7-9/h1-7H,17-18H2