(2-carbamimidoylpyridin-3-yl) 2,3,4-tris(fluoranyl)benzoate

Systemtic Name: (2-carbamimidoylpyridin-3-yl) 2,3,4-tris(fluoranyl)benzoate Openeye Name: (2-carbamimidoyl-3-pyridyl) 2,3,4-trifluorobenzoate CAS Name: 2,3,4-trifluorobenzoic acid (2-carbamimidoyl-3-pyridinyl) ester IUPAC Name: (2-carbamimidoylpyridin-3-yl) 2,3,4-trifluorobenzoate Traditional Name: 2,3,4-trifluorobenzoic acid (2-amidino-3-pyridyl) ester Formula: C13H8F3N3O2 MolecularWeight: 295.21673

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C(=N)N)OC(=O)C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

C1=CC(=C(N=C1)C(=N)N)OC(=O)C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C13H8F3N3O2/c14-7-4-3-6(9(15)10(7)16)13(20)21-8-2-1-5-19-11(8)12(17)18/h1-5H,(H3,17,18)