2-[2,6-bis(azanyl)-3-(trifluoromethyl)phenyl]-3,3,3-tris(fluoranyl)propanoate

Systemtic Name: 2-[2,6-bis(azanyl)-3-(trifluoromethyl)phenyl]-3,3,3-tris(fluoranyl)propanoate Openeye Name: 2-[2,6-diamino-3-(trifluoromethyl)phenyl]-3,3,3-trifluoro-propanoate CAS Name: 2-[2,6-diamino-3-(trifluoromethyl)phenyl]-3,3,3-trifluoropropanoate IUPAC Name: 2-[2,6-diamino-3-(trifluoromethyl)phenyl]-3,3,3-trifluoropropanoate Traditional Name: 2-[2,6-diamino-3-(trifluoromethyl)phenyl]-3,3,3-trifluoro-propionate Formula: C10H7F6N2O2- MolecularWeight: 301.165199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1C(F)(F)F)N)C(C(=O)[O-])C(F)(F)F)N

Isomeric SMILES

C1=CC(=C(C(=C1C(F)(F)F)N)C(C(=O)[O-])C(F)(F)F)N

InChI

InChI=1S/C10H8F6N2O2/c11-9(12,13)3-1-2-4(17)5(7(3)18)6(8(19)20)10(14,15)16/h1-2,6H,17-18H2,(H,19,20)/p-1