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2,3,6-tris(fluoranyl)-5-(piperidin-1-ium-4-ylcarbamoyl)phenolate

2,3,6-tris(fluoranyl)-5-(piperidin-1-ium-4-ylcarbamoyl)phenolate

Systemtic Name:2,3,6-tris(fluoranyl)-5-(piperidin-1-ium-4-ylcarbamoyl)phenolate
Openeye Name:2,3,6-trifluoro-5-(piperidin-1-ium-4-ylcarbamoyl)phenolate
CAS Name:2,3,6-trifluoro-5-[oxo-(4-piperidin-1-iumylamino)methyl]phenolate
IUPAC Name:2,3,6-trifluoro-5-(piperidin-1-ium-4-ylcarbamoyl)phenolate
Traditional Name:2,3,6-trifluoro-5-(piperidin-1-ium-4-ylcarbamoyl)phenolate
Formula: C12H13F3N2O2
MolecularWeight: 274.23903
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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1NC(=O)C2=CC(=C(C(=C2F)[O-])F)F


Isomeric SMILES

C1C[NH2+]CCC1NC(=O)C2=CC(=C(C(=C2F)[O-])F)F


InChI

InChI=1S/C12H13F3N2O2/c13-8-5-7(9(14)11(18)10(8)15)12(19)17-6-1-3-16-4-2-6/h5-6,16,18H,1-4H2,(H,17,19)


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